2-methylpropene-d1 | 65087-61-8

• 分子结构分类: 有机化合物 - 碳氢化合物 - 不饱和烃
• 英文名称: 2-methylpropene-d1
• 英文别名: 2-methylpropene-d；isobutylene-d1；1-deuterio-2-methyl-propene；<1-²H>-2-Methylpropen；1-Deuterio-2-methyl-prop-1-en；1-Deuterio-2-methylprop-1-ene
• CAS: 65087-61-8
• 化学式: C₄H₈
• 分子量: 57.0996
• InChiKey: VQTUBCCKSQIDNK-MICDWDOJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  4
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为反应物：
  描述：

  2-methylpropene-d1 在 溴 作用下， 以 四氯化碳 为溶剂， 生成 C₄H₇⁽²⁾HBr₂
  参考文献：
  名称：

  Direct and regioselective transformation of .alpha.-chlorocarbonyl compounds into alkenes and deuteroalkenes

  摘要：

  DOI：

  10.1021/jo00326a024
• 作为产物：
  描述：

  2-methylprop-1-enyllithium 在 重水 作用下， 以95%的产率得到2-methylpropene-d1
  参考文献：
  名称：

  New syntheses for dilithiotrimethylenemethane: an ionic energy minimum

  摘要：

  DOI：

  10.1021/jo00303a022

文献信息

• Use of simple test reactions to characterise the catalytic activity of a commercial CoO-MoO3-Al2O3 catalyst
  作者：Christopher S. John、James G. Williamson、Lois V. F. Kennedy、J. Kelvin Tyler

  DOI：10.1039/f19807601356

  日期：——

  Exchange of thiophene with D2 and reactions of deuterium-labelled propene and isobutene, followed using a combination of mass spectrometry and microwave spectroscopy, have been used to characterise the catalytic nature of a commercial CoO-MoO3-Al2O3(CMA) catalyst. The results indicate that the activity of partially sulphided CMA, produced by exposure to H2S or by hydrodesulphurization (h.d.s.) of ethanethiol

  噻吩与D 2的交换以及氘标记的丙烯和异丁烯的反应，然后结合质谱和微波光谱法，已用于表征商业CoO-MoO 3 -Al 2 O 3（CMA）的催化性质催化剂。结果表明，通过暴露于H 2 S或乙硫醇的加氢脱硫（hds）产生的部分硫化的CMA的活性与未负载的MoS 2的活性非常相似。因此，硫化CMA对噻吩中的α氢交换显示出高选择性/活性，并通过半氢化中间体催化丙烯中的双键迁移，这是MoS 2的活性特征，而氧化物CMA对α交换的活性低得多，并且对于后者反应显示路易斯酸型活性。似乎在hds期间CMA催化剂可以有用地描述为“双功能”，其中MoS 2负载在酸性载体上并由其稳定。
• Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Ag: MVol.B5, 1.1.2, page 6 - 8
  作者：

  DOI：——

  日期：——
• Structural Dependence of Thermodynamics of Alkene Binding to Yttrium Alkyl Complexes and of Kinetics of Alkyl Migration to Coordinated Alkenes
  作者：Charles P. Casey、Jon A. Tunge、Ting-Yu Lee、Maureen A. Fagan

  DOI：10.1021/ja0209971

  日期：2003.3.1

  Agostic interactions in yttrium alkyls are structure dependent. Primary alkyl yttrium complexes have beta-CH2 agostic interactions at low temperature, but a shift toward alpha-agostic interactions occurs on warming. For the more crowded beta-disubstituted yttrium alkyls, an alpha-CH2 agostic interaction is seen. The thermodynamics of alkene binding to the primary alkyl yttrium complex CP*2YCH2CH2CH(CH3)(2) (2) depend strongly on the structure of the alkene. A single allylic substituent on the alkene has a small effect on alkene binding, but a second allylic substituent has a large destabilizing effect. Propene binding to yttrium alkyls is largely independent of the nature of the alkyl ligand. Equilibrium constants for propene binding to n-, gamma-substituted, beta-substituted, and secondary alkyl yttrium complexes are similar. The rate of migration of an alkyl group to a coordinated alkene depends strongly on the structure of the alkyl group: n-alkyl; gamma-substituted much greater than beta-substituted much greater than alpha-substituted. The similar to200-fold slower insertion of propene into Cp*2YCH(2)-CH(CH3)(2) (6) than that into CP*(2)gammaCH(2)CH(2)CH(CH3)(2) (2) is therefore due to kinetically slow migration of the beta-disubstituted alkyl group of 6 and not to differences in the equilibrium binding of propene. Processes related to chain transfer and site epimerization at the metal center are also reported.
• The formation of isobut-1-enyl radicals from isobut-1-enylsilver. Part I
  作者：F. Glockling

  DOI：10.1039/jr9550000716

  日期：——
• Guo, Zhaoyu; Swenson, Dale C.; Jordan, Richard F., Organometallics, 1994, vol. 13, # 4, p. 1424 - 1432
  作者：Guo, Zhaoyu、Swenson, Dale C.、Jordan, Richard F.

  DOI：——

  日期：——