YAMATAKA Hiroshi 山高博

Researcher Number	60029907
Other IDs
Affiliation (based on the past Project Information) *help	2013: 立教大学, 理学部, 特定課題研究員 2010 – 2012: 立教大学, 理学部, 教授 2006 – 2007: 立教大学, 理学部, 教授 2004: Rikkyo University, Professor, 理学部, 教授 2003: 大阪大学, 産業科学研究所, 助教授 … More 2000 – 2001: 大阪大学, 産業科学研究所, 助教授 1999: 大阪大学, 産業科学研究科, 助教授 1996: Osaka University, Institute of Scientific and Industrial Research, Associate Professor, 産業科学研究所, 助教授 1995 – 1996: 九州大学, 有機化学基礎研究センター, 助教授 1991 – 1993: 大阪大学, 産業科学研究所, 助教授 1990: 大阪大学産業科学研究所, 助教授 1986: Inst. Sci. Ind. Res., Osaka University, 産業科学研究所, 講師 Less
Review Section/Research Field	Principal Investigator Organic chemistry / Organic chemistry / 有機化学一般 / Science and Engineering Except Principal Investigator 有機化学一般 / Organic chemistry
Keywords	Principal Investigator 遷移状態 / 電子移動 / 溶媒効果 / 分子軌道法 / QM / 有機反応機構 / 分子動力学 / 求核付加反応 / 有機リチウム試剤 / 置換基効果 … More / 同位体効果 / グリニャール反応 / 一電子移動 / nitroalkane anomaly / Wittig反応 / Nucleophilic substitution / Kinetics / Pth bifurcation / Dynamics-driven reaction / Transition state / Organic reaction mechanism / Molecular dynamics simulations / Beckmann reaction / C=N異性化反応 / SN2反応 / 反応速度論 / ベックマン転位 / 求核置換反応 / ダイナミクス支配 / 反応経路分岐 / 反応動力学 / Grignard reaction mechanism / transition state / reaction pathways / solvent effect / molecular dynamics simulations / molecular orbital calculations / MM calculations / 直線自由エネルギー関係則 / 遷移状態構造 / 安定単純エノール / 非経験的分子軌道法計算 / 遷移状 / ニトロアルカン異常性 / 分子動力学法 / 有機反応経路 / MM法 / Transition State / Organic Reaction Mechanism / Borderline Reaction / Molecular Dynamics / S_N2 Reaction / Electron Transfer / 境界領域 / S_N2反応 / probe experiment / organolithium reagent / substituent effect / isotope effect / polar mechanism / electron transfer / nucleophilic addition / carbonyl compound / リチウムエノラート / 非経験的分子軌道法 / リンイリド / 反応速度同位体効果 / 極性機構 / カルボニル化合物 / Stereoselectivity / Substituent Effect / Isotope Effect / Wittig Reaction / Grignard Reaction / Reaction Mechanism / Reaction Route / Single Electron Transfer / ケチルラジカルプロ-ブ / グリニャ-ル試剤 / クリニャール反応 / 立体選択性 / ウィティッヒ反応 / 反応機構 / 反応経路 / シミュレーション / 量子化学 / 有機化学反応 / transision state imbalance / プロトントランスファー / transition state imbalance / 酸塩基平衡 / 反応選択性 / イリド / Corey反応 … More Except Principal Investigator Dendrimer / Ultrasound / Solid Support / Heterogeneous Reaction / 固体担持試薬 / 超音波 / 固体担体 / 不均一系有機反応 / Green Chemistry / Self-assembly / Immobilization / Metal Cluster / Micelle / Catalyst Analog / Dendron / PAMAM / 固相合成 / 複合金属触媒 / ビナフトール / 不斉触媒 / 自己集合 / 金クラスター / 固定化触媒 / BINOL / 不斉 / ALB / 環境調和型プロセス / 自己組織化 / 固定化不斉触媒 / 金属クラスター / ミセル / 触媒アナログ / デンドロン / デンドリマー / Calcium fluoride / Aklyl halide / Lead(II)fluoride / Organofluorine compound / Organic fluorination / Composite solid reagent / Solid-liquid interfacial reaction / フッ素化反応 / ハロゲン化アルキル / フッ化鉛 / 有機フッ素化合物 / 有機フッ素化反応 / 固体複合試薬 / 固・液界面反応 / 溶媒効果理論 / 溶液反応過程 / ミクロ溶媒効果 / 有機素反応 / キチン・キトサン / 不均一系反応 / エナンチオ面区別付加 Less

Microscopic Analysis of Dynamics-Controlled Organic ReactionsPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  2010 – 2013
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Organic chemistry
- Research Institution
  Rikkyo University
Combined experimental and Computational Study on New Concept of Dynamics-Driven Organic Reaction and Path BifurcationPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  2006 – 2007
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Organic chemistry
- Research Institution
  Rikkyo University
Mechanism of organic reaction in solution : kinetics experiment and new QM/MM computationsPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  2003 – 2004
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Organic chemistry
- Research Institution
  Rikkyo University
  Osaka University
Nitroalkane Anomaly:酸-塩基反応の異常性の解明Principal Investigator
- Principal Investigator
  
  山高博
- Project Period (FY)
  2000 – 2001
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas (A)
- Review Section
  
  Science and Engineering
- Research Institution
  Osaka University
Elucidation of Electron-Transfer/S_N2 Borderline Mechanism : Toward the Development of a New Reaction TheoryPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  2000 – 2001
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Organic chemistry
- Research Institution
  Osaka University
Dendrimer Assisted Solid Phase Synthesis of Heterobimetallic Asymmetric Catalyst
- Principal Investigator
  
  SASAI Hiroaki
- Project Period (FY)
  1999 – 2001
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  Organic chemistry
- Research Institution
  Osaka University
有機素反応理論の成立
- Principal Investigator
  
  大野惇吉
- Project Period (FY)
  1996
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Organic chemistry
- Research Institution
  Kyoto University
Reaction Route of Nucleophilic Addition to Carbonyl Compounds : Intermediate, Transition State and SelectivityPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  1995 – 1996
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Research Field
  
  Organic chemistry
- Research Institution
  Osaka University
  Kyushu University
反応経路決定因子の解明:Wittig反応かCorey反応か?Principal Investigator
- Principal Investigator
  
  山高博
- Project Period (FY)
  1993
- Research Category
  
  Grant-in-Aid for General Scientific Research (C)
- Research Field
  
  Organic chemistry
- Research Institution
  Osaka University
New Synthesis of Organofluorine Compounds Using Solid-Liquid Interface
- Principal Investigator
  
  ICHIHARA Junko
- Project Period (FY)
  1992 – 1993
- Research Category
  
  Grant-in-Aid for General Scientific Research (C)
- Research Field
  
  有機化学一般
- Research Institution
  Osaka University
Nucleophilic Carbonyl Addition of Organometallics: Reaction Pathway, Transition State Structure and StereoselectivityPrincipal Investigator
- Principal Investigator
  
  YAMATAKA Hiroshi
- Project Period (FY)
  1991 – 1992
- Research Category
  
  Grant-in-Aid for General Scientific Research (C)
- Research Field
  
  有機化学一般
- Research Institution
  Osaka University
キラルな固体表面によるエナンチオ面区別反応
- Principal Investigator
  
  HANAFUSA Terukiyo
- Project Period (FY)
  1990
- Research Category
  
  Grant-in-Aid for General Scientific Research (C)
- Research Field
  
  有機化学一般
- Research Institution
  Osaka University
Acceleration of Organic Reactions: The Use of Solid-Support and Ultrasound
- Principal Investigator
  
  HANAFUSA Terukiyo
- Project Period (FY)
  1985 – 1986
- Research Category
  
  Grant-in-Aid for General Scientific Research (B)
- Research Field
  
  有機化学一般
- Research Institution
  Osaka University

All 2014 2013 2012 2011 2010 2007 2006 2004 2003 Other

All Journal Article Presentation Book Other

[Book] The Chemistry of Organolithium Compounds : Addition of Organolithium Reagents to Double Bonds2004
- Author(s)
  H.Yamataka, K.Yamada, K.Tomioka
- Publisher
  John Wiley & Sons, Ltd.
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] 分子シミュレーションによる有機反応機構解析 : 動力学的効果の検討2014
- Author(s)
  佐藤真, 山高博
- Journal Title
  
  有機合成化学協会誌
  
  Volume: Vol.72, No.4 Pages: 393-404
- NAID
  130004548590
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] 分子シミュレーションによる有機反応機構解析：動力学的効果の検討2014
- Author(s)
  佐藤　真, 山高　博
- Journal Title
  
  有機合成化学協会誌
  
  Volume: 72
- NAID
  130004548590
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Mechanism of α-Ketol-Type Rearrangement of Benzoin Derivatives under Basic Conditions2013
- Author(s)
  M. Karino, D. Kubouchi, K. Hamaoka, S. Umeyama, H. Yamataka
- Journal Title
  
  J. Org. Chem
  
  Volume: 78 Issue: 14 Pages: 7194-7198
- DOI
  10.1021/jo401156h
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Reaction Pathway and Rate-Determining Step of the Schmidt Rearrangement/Fragmentation : A Kinetic Study2012
- Author(s)
  R. Akimoto, T. Tokugawa, Y. Yamamoto, H. Yamataka
- Journal Title
  
  J. Org. Chem
  
  Volume: 77 Issue: 8 Pages: 4073-4078
- DOI
  10.1021/jo300419c
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] FMO-MD Simulations on Hydration of Formaldehyde in Water Solution with Constraint Dynamics2012
- Author(s)
  M. Sato, H. Yamataka, Y. Komeiji, Y. Mochizuki
- Journal Title
  
  Chem. Eur. J
  
  Volume: 18 Issue: 31 Pages: 9714-9721
- DOI
  10.1002/chem.201200874
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Dynamic Path Bifurcation in the Beckmann Reaction : Support from Kinetic Analyses2011
- Author(s)
  Y. Yamamoto, H. Hasegawa, H. Yamataka
- Journal Title
  
  J. Org. Chem
  
  Volume: 76 Issue: 11 Pages: 4652-4660
- DOI
  10.1021/jo200728t
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Dynamics Effects on E2/E1cb Borderline Mechanism. Unimolecular Elimination of 2-Aryl-3- chloro-2-R-propanols2011
- Author(s)
  S. Itoh, H. Yamataka
- Journal Title
  
  Chem. Eur. J
  
  Volume: 17 Issue: 4 Pages: 1230-1237
- DOI
  10.1002/chem.201001926
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Kinetic Study of Proton-Transfer Reactions of Phenylnitromethanes. Implication for the Origin of Nitroalkane Anomaly2011
- Author(s)
  K.Ando, Y.Shimazu, N.Seki, H.Yamataka
- Journal Title
  
  Journal of Organic Chemistry
  
  Volume: 76 Issue: 10 Pages: 3937-3945
- DOI
  10.1021/jo200383f
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Dynamics Effects on E2/E1cb Borderline Mechanism. Unimolecular Elimination of 2-Aryl-3-chloro-2-R-propanols.2011
- Author(s)
  S.Itoh, H.Yamataka
- Journal Title
  
  Chemistry, A European Journal
  
  Volume: 17 Pages: 1230-1237
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Fragment molecular orbital-based molecular dynamics (FMO-MD) method with MP2 gradient.2011
- Author(s)
  Y.Mochizuki, T.Nakano, Y.Komeiji, K.Yamashita, Y.Okiyama, H.Yoshikawa, H.Yamataka
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 504 Pages: 95-99
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] A Computational Study on the Reaction Pathway of □-Bromoacetophenones with Hydroxide Ion : Possible Path Bifurcation in Addition/Substitution Mechanism2011
- Author(s)
  S.Itoh, N.Yoshimura, M.Sato, H.Yamataka
- Journal Title
  
  Journal of Organic Chemistry
  
  Volume: 76 Issue: 20 Pages: 8294-8299
- DOI
  10.1021/jo201485y
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Fragment Molecular Orbital-Based Molecular Dynamics (FMO-MD) Method with MP2 Gradient2011
- Author(s)
  Y.Mochizuki, T.Nakano, K.Komeiji, K.Yamashita, Y.Okiyama, H.Yoshikawa, H.Yamataka
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 504 Issue: 1-3 Pages: 95-99
- DOI
  10.1016/j.cplett.2011.01.039
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Does Amination of Formaldehyde Proceeds through Zwitterionic Intermediate in Water? FMO-MD Simulations by Using Constraint Dynamics2010
- Author(s)
  M.Sato, H.Yamataka, Y.Komeiji, Y.Mochizuki, T.Nakano
- Journal Title
  
  Chemistry, A European Journal
  
  Volume: 16 Pages: 6430-6433
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Reaction Pathways and Possible Path Bifurcation for the Schmidt Reaction.2010
- Author(s)
  T.Katori, S.Itoh, M.Sato, H.Yamataka
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: 132 Pages: 3413-3422
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Reaction Pathways and Possible Path Bifurcation for the Schmidt Reaction2010
- Author(s)
  T. Katori, S. Itoh, M. Sato, H. Yamataka
- Journal Title
  
  J. Am. Chem. Soc
  
  Volume: 132 Issue: 10 Pages: 3413-3422
- DOI
  10.1021/ja908899u
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] Reaction Pathway of Aliphatic Pinacol-type Rearrangement Reexamined2010
- Author(s)
  S.Itoh, H.Yamataka
- Journal Title
  
  Journal of Physical Organic Chemistry
  
  Volume: 23 Pages: 789-795
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22350023
[Journal Article] G2(+) Investigation on the α-Effect in the S_NII Reactions at Saturated Carbon2007
- Author(s)
  Yi Ren, Hiroshi Yamataka
- Journal Title
  
  Chemistry, A European Journal 13
  
  Pages: 677-682
- Data Source
  KAKENHI-PROJECT-18550047
[Journal Article] Hydrolysis of alpha-Alkyl-alpha-(methylthio)-methylene Meldrum's Acids. A Kinetic and Computational Investigation of Steric Effects2006
- Author(s)
  Claude F.Bernasconi, Shoshana D.Brown, Mahammad Ali, Zvi Rappoport, Hiroshi Yamataka, Hatim Salim
- Journal Title
  
  The Journal of Organic Chemistry 71
  
  Pages: 4795-4802
- Data Source
  KAKENHI-PROJECT-18550047
[Journal Article] Computation Revealed a Case Where Kinetic Selectivity is Controlled by Dynamics : Isomerization of Benzylideneanilines2006
- Author(s)
  S.C.Ammal, H.Yamataka
- Journal Title
  
  European Journal of Organic Chemistry
  
  Pages: 4327-4330
- Data Source
  KAKENHI-PROJECT-18550047
[Journal Article] The α-Effect in the Gas-Phase S_N2 Reactions Revisited2006
- Author(s)
  Y.Ren, H.Yamataka
- Journal Title
  
  Organic Letters 8
  
  Pages: 119-121
- Data Source
  KAKENHI-PROJECT-18550047
[Journal Article] Direct Rate Measurements of the Reactions of Benzophenone with RMgX and RLi : Effects of Substituents and Reagent Concentration on Rates2004
- Author(s)
  M.Shimizu, H.Yamataka
- Journal Title
  
  Bulletin of the Chemical Society of Japan 77
  
  Pages: 1757-1761
- NAID
  10013584847
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] Dual Activation in a Homolytic Coupling Reaction Promoted by an Enantioselective Dinuclear Vanadium(IV) Catalyst2004
- Author(s)
  H.Somei, Y.Asano, T.Takizawa, H.Yamataka, H.Sasai
- Journal Title
  
  Tetrahedron Letters 45
  
  Pages: 1841-1844
- NAID
  130006997291
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] The Chemistry of Organo lithium Compounds : Addition of Organolithium Reagents to Double Bonds2004
- Author(s)
  H.Yamataka, K.Yamada, K.Tomioka
- Journal Title
  
  The Chemistry of Functional Group
  
  Pages: 901-939
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] The 1-N-(methoxycarbonyl-2-phenylethyl)imino-2,2,2-trifluoroethanephosphonate Systems are not Stable Enols of Carboxylic Esters2003
- Author(s)
  J.Song, H.Yamataka, Z.Rappoport
- Journal Title
  
  Journal of Fluorine Chemistry 124
  
  Pages: 119-122
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] Are Linear Free Energy Relationship and Kinetic Isotope Effects Good Measures for the Transition State Variation? A Computational Study2003
- Author(s)
  S.C.Ammal, M.Mishima, H.Yamataka
- Journal Title
  
  Journal of Organic Chemistry 68
  
  Pages: 7772-7778
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] The 1-N-(methoxycarbonyl-2-phenylethyl)imino-2,2,2-trifluoroethane-phosphonate Systems are not Stable Enols of Carboxylic Esters2003
- Author(s)
  J.Song, H.Yamataka, Z.Rappoport
- Journal Title
  
  Journal of Fluorine Chemistry 124
  
  Pages: 119-122
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] Ab Initio Molecular Dynamics Studies on Substitution vs. Electron Transfer Reactions of Substituted Ketyl Radical Anions with Chloroalkanes : How Do the Two Products Form in a Borderline Mechanism?2003
- Author(s)
  H.Yamataka, M.Aida, M.Dupuis
- Journal Title
  
  Journal of Physical Organic Chemistry 16
  
  Pages: 475-483
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Journal Article] Nitroalkane Anomaly : Computational Study with Cluster and Continuum Modeling2003
- Author(s)
  H.Yamataka, S.C.Ammal
- Journal Title
  
  ARKIVOC
  
  Pages: 56-68
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-15550034
[Presentation] 置換フェナシルクロリドとメトキシドイオンの反応機構の解析2012
- Author(s)
  田川耕平、笹川慶太、山高博
- Organizer
  第92日本化学会春季年会
- Place of Presentation
  神奈川
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] Reaction Pathway, Rate-Determining Step, and Possible Path Bifurcation of the Schmidt Reaction2012
- Author(s)
  R. Akimoto, T. Tokugawa, Y. Yamamoto, and H. Yamataka
- Organizer
  21th IUPAC Conference on Physical Organic Chemistry
- Place of Presentation
  Durham, UK
- Year and Date
  2012-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] 酸性・塩基性条件下におけるアシロイン水素移動反応の速度論的研究2012
- Author(s)
  窪内大輝、狩野真啓、山高博
- Organizer
  第92日本化学会春季年会
- Place of Presentation
  神奈川
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] FMO-MDを用いた水溶液中におけるt-BuClの加水分解反応シミュレーション2012
- Author(s)
  佐藤真、山高博、古明地勇人、望月祐志、中野達也
- Organizer
  第92日本化学会春季年会
- Place of Presentation
  神奈川
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] ニトロナートアンビデントアニオンのメチル化機構の速度論的研究2012
- Author(s)
  坂田朋末、山高博
- Organizer
  第92日本化学会春季年会
- Place of Presentation
  神奈川
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] 理論計算によるビニルカチオン生成反応の解析2012
- Author(s)
  神宮路賢、山高博
- Organizer
  第92日本化学会春季年会
- Place of Presentation
  神奈川
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] アシロイン水素移動反応の速度論的研究2011
- Author(s)
  窪内大輝、狩野真啓、山高博
- Organizer
  第22回基礎有機化学討論会
- Place of Presentation
  つくば
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] フェニルメチルニトロナートアンビデントアニオンのメチル化機構の速度論的研究2011
- Author(s)
  坂田朋未、山高博
- Organizer
  第22回基礎有機化学討論会
- Place of Presentation
  つくば
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] 置換フェナシルクロリドとメトキシドイオンの反応の置換基効果による解析2011
- Author(s)
  田川耕平、笹川慶太、山高博
- Organizer
  第22回基礎有機化学討論会
- Place of Presentation
  つくば
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] フェナシルクロリドとメトキシドイオンの反応経路の解析32011
- Author(s)
  笹川慶太、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] アシロインの二重水素転位反応に関する理論的解析2011
- Author(s)
  神宮路賢、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] α-ブロモアセトフェノンの求核反応における置換/付加反応の境界領域の計算化学的解析2011
- Author(s)
  伊藤晋平、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] MOおよびMD計算によるビニルジアゾニウムイオンの窒素脱離における経路分岐現象の検討2011
- Author(s)
  綿貫亜美、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] フェニルメチルニトロナートアンビデントアニオンのメチル化機構の速度論的研究2011
- Author(s)
  坂田朋未、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] アシロイン誘導体の水素転位反応に関する理論的研究2011
- Author(s)
  神宮路賢、山高博
- Organizer
  第22回基礎有機化学討論会
- Place of Presentation
  つくば
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] シュミソト転位と断片化の反応経路に関する実験的研究2011
- Author(s)
  山本雄太郎、秋元諒、山高博
- Organizer
  第91日本化学会春季年会
- Place of Presentation
  神奈川
- Year and Date
  2011-03-26
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] Combined Experimental-Computational Study on the Reaction Pathway of α-Haloacetophenones with Nucleophiles : Possible Path Bifurcation in Addition/Substitution Mechanism2011
- Author(s)
  S. Itoh, M. Katayama, K. Sasagawa, N. Yoshimura, M. Sato, H. Yamataka
- Organizer
  13th European Symposium on Organic Reactivity
- Place of Presentation
  Tallinn, Estonia
- Year and Date
  2011-09-12
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] A Theoretical Study of Borderline Mechanism of Nucleophilic Addition/Substitution Reaction of α-bromoacetophenone.2010
- Author(s)
  S.Itoh, H.Yamataka
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  釜山(韓国)
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] α-ブロモアセトフェノンの求核攻撃に出現する経路分岐現象の計算化学的解析2010
- Author(s)
  伊藤晋平、山高博
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] An Analysis of the Reaction Pathway of Phenacyl Chloride with Methoxide Ion.2010
- Author(s)
  K.Sasagawa, H.Yamataka
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  釜山(韓国)
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] フェニルメチルニトロナートのメチル化機構の速度論的研究2010
- Author(s)
  坂田朋未、山高博
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] MDを利用した水溶液中におけるt-BuClの加水分解反応シミュレーション2010
- Author(s)
  佐藤真、山高博、古明地勇人、望月祐志、中野達也
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] Experimental study on the reaction pathway of Schmidt rearrangement and fragmentation.2010
- Author(s)
  Y.Yamamoto, R.Akimoto, H.Yamataka
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  釜山(韓国)
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] アシロイン誘導体の水素移動反応に関する理論的研究2010
- Author(s)
  神宮路賢、山高博
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] Dynamic path bifurcation in the Beckmann reaction : Support from kinetic analyses2010
- Author(s)
  Y.Yamamoto, H.Hasegawa, H.Yamataka
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  釜山(韓国)
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] Theoretical Analysis of Amination of Fornaldehyde : FMO-MD Simulations by Using Constraint Dynamics.2010
- Author(s)
  M.Sato, H.Yamataka, Y.Komeji, Y.Mochizuki, T.Nakano
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  釜山(韓国)
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] A Theoretical Study of Borderline Mechanism of Nucleophilic Addition/Substitution Reaction of α-bromoacetophenone2010
- Author(s)
  S. Itoh, H. Yamataka
- Organizer
  International Conference on Physical Organic Chemistry
- Place of Presentation
  Pusan, South Korea
- Year and Date
  2010-08-28
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] フェナシルクロリドとメトキシドイオンの反応経路の解析22010
- Author(s)
  笹川慶太、山高博
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] 1-置換フェニル-2-プロパノンオキシム類のベックマン転位と断片化の反応経路に関する研究2010
- Author(s)
  山本雄太郎、長谷川拡人、山高博
- Organizer
  第21回基礎有機化学討論会
- Place of Presentation
  名古屋
- Year and Date
  2010-09-09
- Data Source
  KAKENHI-PROJECT-22350023
[Presentation] A Combined Experimental-Computational Study on the Proton-Transfer Reaction of phenylnitromethane2007
- Author(s)
  H.Yamataka
- Organizer
  XIth European Symposium on Organic Reactivity
- Place of Presentation
  Faro,Portugal
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-18550047
[Presentation] A Combined Experimental-Computational Study on the Proton-Transfer Reaction of phenylnitromethane2007
- Author(s)
  H. Yamataka
- Organizer
  Xith European Symposium on Organic Reactivity
- Place of Presentation
  Faro, portugal
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-18550047
[Presentation] 速度論実験と理論計算による有機反応機構の検証2007
- Author(s)
  山高博
- Organizer
  第57回有機反応化学討論会
- Place of Presentation
  東広島
- Year and Date
  2007-09-29
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-18550047
[Presentation] S_N2反応におけるα効果の再考:α求核種は本当に反応を加速するか2006
- Author(s)
  山高博
- Organizer
  第18回基礎有機化学連合討論会
- Place of Presentation
  福岡
- Year and Date
  2006-10-06
- Description
  「研究成果報告書概要(和文)」より
- Data Source
  KAKENHI-PROJECT-18550047
[Presentation] The α-effects in the Gas-phadse S_N2 Reactions at Saturated Carbon Centers2006
- Author(s)
  H. Yamataka
- Organizer
  18th IUPAC Conference on Physical Organic Chemistry
- Place of Presentation
  Warsaw
- Description
  「研究成果報告書概要(欧文)」より
- Data Source
  KAKENHI-PROJECT-18550047
[Presentation] 2-メチル-3-置換フェニル-(E)-プロペニル-1-ジアゾニウムイオンの転位および断片化反応における動力学的効果
- Author(s)
  佐藤　真, 綿貫亜美, 柊澤康介, 山高　博
- Organizer
  日本化学会第94春季年会
- Place of Presentation
  名古屋
- Data Source
  KAKENHI-PROJECT-22350023
[]

1. ICHIHARA Junko (60110772)

# of Collaborated Projects: 6 results

# of Collaborated Products: 0 results
2. HANAFUSA Terukiyo (70033777)

# of Collaborated Projects: 2 results

# of Collaborated Products: 0 results
3. MOCHIZUKI Yuji (00434209)

# of Collaborated Projects: 1 results

# of Collaborated Products: 7 results
4. KOMEIJI Yuto (30357032)

# of Collaborated Projects: 1 results

# of Collaborated Products: 6 results
5. SATO Makoto (10634347)

# of Collaborated Projects: 1 results

# of Collaborated Products: 12 results
6. ITO Yoshiaki (40223200)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
7. SASAI Hiroaki (90205831)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
8. TAKIZAWA Shinobu (50324851)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
9. KIMURA Norio (80195370)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
10. ANDO Takashi (70029867)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
11. 山口俊郎 (40167698)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
12. 大野惇吉 (70027077)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
13. 辻孝 (20029482)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
14. 奥山格 (40029484)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
15. 浅野努 (40094057)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
16. 竹内賢一 (50026358)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
17. 桑谷善之 (00234625)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
18. 荒井孝義 (80272483)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results

YAMATAKA Hiroshi 山高 博

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Co-Researchers

Microscopic Analysis of Dynamics-Controlled Organic ReactionsPrincipal Investigator

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Combined experimental and Computational Study on New Concept of Dynamics-Driven Organic Reaction and Path BifurcationPrincipal Investigator

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Mechanism of organic reaction in solution : kinetics experiment and new QM/MM computationsPrincipal Investigator

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Nitroalkane Anomaly:酸-塩基反応の異常性の解明Principal Investigator

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Elucidation of Electron-Transfer/S_N2 Borderline Mechanism : Toward the Development of a New Reaction TheoryPrincipal Investigator

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Dendrimer Assisted Solid Phase Synthesis of Heterobimetallic Asymmetric Catalyst

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有機素反応理論の成立

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Reaction Route of Nucleophilic Addition to Carbonyl Compounds : Intermediate, Transition State and SelectivityPrincipal Investigator

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反応経路決定因子の解明:Wittig反応かCorey反応か?Principal Investigator

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New Synthesis of Organofluorine Compounds Using Solid-Liquid Interface

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Nucleophilic Carbonyl Addition of Organometallics: Reaction Pathway, Transition State Structure and StereoselectivityPrincipal Investigator

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キラルな固体表面によるエナンチオ面区別反応

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Acceleration of Organic Reactions: The Use of Solid-Support and Ultrasound

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YAMATAKA Hiroshi 山高博