cyclohexane-d₂ | 98821-91-1

• 分子结构分类: 有机化合物 - 碳氢化合物 - 饱和烃
• 英文名称: cyclohexane-d₂
• 英文别名: cyclohexane-1,2-d2；cyclohexene-1,2-d2；1,2-dideuterio-cyclohexane；1.2-Dideutero-cyclohexan；Cyclohexan-1,2-d2；1,2-Dideuterocyclohexane；1,2-dideuteriocyclohexane
• CAS: 98821-91-1
• 化学式: C₆H₁₂
• 分子量: 86.1454
• InChiKey: XDTMQSROBMDMFD-QDNHWIQGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  6
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  dichloro-(2-dichloroalumanylcyclohexyl)alumane 在 D₂O 作用下， 以 甲基环己烷 为溶剂， 生成 cyclohexane-d₂
  参考文献：
  名称：

  二氯化铝和二溴化铝。有机铝化合物制备中的制备、光谱（包括基质分离）研究、反应和作用（与烷基（芳基）铝单卤化物一起）

  摘要：

  制备 de dichlorure ou dibromure d'Al et de Al 2 (i-Bu) 4-x Cl x 。(AlCl 2 ) 2 烯烃的反应练习曲。Le traitement par les Ultrasons 主动 CES 反应

  DOI：

  10.1021/ja00218a037

文献信息

• Well-Defined Cobalt(I) Dihydrogen Catalyst: Experimental Evidence for a Co(I)/Co(III) Redox Process in Olefin Hydrogenation
  作者：Kenan Tokmic、Charles R. Markus、Lingyang Zhu、Alison R. Fout

  DOI：10.1021/jacs.6b07066

  日期：2016.9.14

  the addition of Cp2ZrHCl, evolves hydrogen gas and regenerates the Co(I)-(N2) complex. Furthermore, the catalytic olefin hydrogenation activity of the Co(I) species was studied by using multinuclear and parahydrogen (p-H2) induced polarization (PHIP) transfer NMR studies to elucidate catalytically relevant intermediates, as well as to establish the role of the Co(I)-(H2) in the Co(I)/Co(III) redox cycle

  由 Co(I)-(N2) 前驱体制备的二氢钴 Co(I)-(H2) 复合物的合成，该前驱体由单阴离子钳形双（卡宾）配体（Mes）CCC（（Mes）CCC = bis（甲基-苯并咪唑-2-亚基)苯基)，描述。该物种能够在室温下对烯烃进行 H2/D2 加扰和氢化。将 HCl 化学计量添加到 Co(I)-(N2) 中，干净地提供了 Co(III) 氢氯化物络合物，在加入 Cp2ZrHCl 后，会放出氢气并再生 Co(I)-(N2) 络合物。此外，通过使用多核和仲氢 (p-H2) 诱导极化 (PHIP) 转移核磁共振研究来研究 Co(I) 物种的催化烯烃加氢活性，以阐明催化相关的中间体，并确定 Co (I)-(H2) 在 Co(I)/Co(III) 氧化还原循环中。
• Coordination and Hydrogenation of 1,3-Cyclohexadiene by Niobium and Tantalum Aryl Oxide Compounds:  Relevance to Catalytic Arene Hydrogenation
  作者：Valerie M. Visciglio、Janet R. Clark、Mindy T. Nguyen、Douglas R. Mulford、Phillip E. Fanwick、Ian P. Rothwell

  DOI：10.1021/ja964073n

  日期：1997.4.1

  of the chloro, aryl oxide compounds [M(OC6H3Pri2-2,6)2Cl3]2 (1) and [M(OC6H3Pri2-2,6)3Cl2] (2) (a, M = Nb; b, M = Ta) in the presence of 1,3-cyclohexadiene leads to formation of the η4-cyclohexadiene derivatives [M(OC6H3Pri2-2,6)2Cl(η4-C6H8)] (3) and [M(OC6H3Pri2-2,6)3(η4-C6H8)] (4). Spectroscopic studies of compounds 3 and 4 show in all cases a strongly bound cyclohexadiene ligand which does not readily

  氯、芳基氧化物化合物 [M(OC6H3Pri2-2,6)2Cl3]2 (1) 和 [M(OC6H3Pri2-2,6)3Cl2] (2) 的碳氢化合物溶液的钠汞齐（每 M 2 Na）还原(a, M = Nb; b, M = Ta) 在 1,3-环己二烯存在下导致形成 η4-环己二烯衍生物 [M(OC6H3Pri2-2,6)2Cl(η4-C6H8)] (3)和 [M(OC6H3Pri2-2,6)3(η4- )] (4)。化合物 3 和 4 的光谱研究在所有情况下都显示出强结合的环己二烯配体，该配体不易被添加的试剂如 PMe2Ph 和环己烯置换 (NMR)。3a 和同晶对 4a 和 4b 的单晶 X 射线衍射分析在所有三种情况下都显示了围绕金属中心的几何形状，最好将其描述为三腿钢琴凳。化合物4a会催化1的歧化，3-环己二烯生成环己烯和苯，以及1,3-环己二烯和环己烯加氢生成环己烷。机理研究清楚地表明，环己烯在
• Highly reactive organolanthanides. A mechanistic study of catalytic olefin hydrogenation by bis(pentamethylcyclopentadienyl) and related 4f complexes
  作者：Gerald Jeske、Harald Lauke、Heiko Mauermann、Herbert Schumann、Tobin J. Marks

  DOI：10.1021/ja00312a052

  日期：1985.12
• Low-Temperature Hydrogenation of Cyclohexene by Energetic Forms of Hydrogen on the Ni(100) Surface
  作者：Kyung-Ah Son、Manos Mavrikakis、John L. Gland

  DOI：10.1021/j100017a003

  日期：1995.4

  Adsorbed cyclohexene can be hydrogenated at cryogenic temperatures by both incident gas phase atomic hydrogen and desorbing bulk hydrogen in the presence of adsorbed surface hydrogen on a Ni(100) surface. In both cases, no C-C bond activation is observed, and cyclohexane is the only hydrogenated product. Cyclohexene desorbs without significant reaction from the Ni(100) surface in the presence of coadsorbed surface hydrogen. Selective hydrogenation of adsorbed cyclohexene by bulk hydrogen is observed at 178 K in the leading edge of the bulk hydrogen desorption peak. Hydrogenation of adsorbed cyclohexene by gas phase atomic hydrogen is observed below 140 K. Isotope studies of the hydrogenation mechanism suggest that the hydrogenation of adsorbed cyclohexene by gas phase atomic hydrogen is a sequential process with the first hydrogen adding from the gas phase and the second from the surface. The small amount of benzene observed from adsorbed cyclohexene monolayers indicates that gas phase atomic hydrogen also causes some hydrogen abstraction.
• BEERI AHUVA; BERMAN ELISHA; VISHKAUTSAN ROSITA; MAZUR YEHUDA, J. AMER. CHEM. SOC., 108,(1986) N 20, 6413-6414
  作者：BEERI AHUVA、 BERMAN ELISHA、 VISHKAUTSAN ROSITA、 MAZUR YEHUDA

  DOI：——

  日期：——