cyclohexyl-pyrrol-2-ylmethyl-amine | 100051-14-7

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: cyclohexyl-pyrrol-2-ylmethyl-amine
• 英文别名: Cyclohexyl-pyrrol-2-ylmethyl-amin；N-(1H-pyrrol-2-ylmethyl)cyclohexanamine
• CAS: 100051-14-7
• 化学式: C₁₁H₁₈N₂
• 分子量: 178.277
• InChiKey: IASBJSLCBARKIB-UHFFFAOYSA-N

物化性质

• 熔点：
  52.5-54 °C(Solv: ligroine (8032-32-4))
• 沸点：
  310.9±17.0 °C(Predicted)
• 密度：
  1.02±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  13
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.64
• 拓扑面积：
  27.8
• 氢给体数：
  2
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  cyclohexyl-pyrrol-2-ylmethyl-amine 、 四甲基乙二胺 在 正丁基锂 作用下， 以 正己烷 为溶剂， 反应 8.0h， 以65%的产率得到
  参考文献：
  名称：

  2-Aminopyrrolyl Dilithium Compounds: Synthesis, Structural Diversity, and Catalytic Activity for Amidation of Aldehydes with Amines

  摘要：

  Five dilithium compounds containing bidentate dianionic pyrrolyl ligands, [{2-(CH3NCH2)C4H3N}Li-2(TMEDA)(3)] (1), {[mu-eta(5)-2- [ CH3CH2NCH2] C4H3N]Li-2(TMEDA)}(2) (2), {[Pris eta(5):eta(1)-2-[(CH3)(3)CNCH2]C4H3N]Li-2(TMEDA)}(2) (3), {[eta(5)-2-[(CH3)(2)CHNCH2]C4H3N]Li-2 (TMEDA)}(2) (4), and {[eta(5)-2-[(CH2)(5)CHNCH2]C4H3N1Li2(TMEDA)}(2) (5), were synthesized, and their structural features were provided. Compounds 1-5 were proved to be a series of efficient catalysts for amidation reactions of aldehydes with amines in good to excellent yields under mild conditions.

  DOI：

  10.1021/om4006609
• 作为产物：
  描述：

  吡咯 、 N-(benzotriazol-1-yl-methyl)-cyclohexylamine 在 zinc(II) chloride 作用下， 以 二氯甲烷 为溶剂， 反应 3.0h， 以64%的产率得到cyclohexyl-pyrrol-2-ylmethyl-amine
  参考文献：
  名称：

  Aminoalkylbenzotriazoles: reagents for the aminoalkylation of electron rich heterocycles

  摘要：

  Secondary and tertiary aminoalkylbenzotriazoles react with pyrrole, indole, their N-methyl analogs and with 2-methylfuran under mild reaction conditions in the presence of a Lewis acid to afford selectively the corresponding secondary or tertiary amines.

  DOI：

  10.1016/s0040-4020(01)81590-8

文献信息

• EQUILIBRATED DYNAMIC MIXTURES TO CONTROL THE RELEASE OF PERFUMING ALDEHYDES AND KETONES
  申请人：Herrmann Andreas

  公开号：US20140038873A1

  公开（公告）日：2014-02-06

  The present invention concerns a dynamic mixture obtained by combining, in the presence of water, at least one diamine derivative, comprising at least one heteroaryl moiety, with at least two perfuming aldehydes and/or ketones. The invention's mixture is capable of releasing in a controlled and prolonged manner said perfuming compounds, in particular perfuming ingredients, into the surrounding environment. The invention's dynamic mixture gives rise to a more evenly distributed positive effect for the release of the different carbonyl compounds which are part of the mixture than other examples reported in the prior art.

  本发明涉及一种动态混合物，该混合物是通过在水的存在下将至少一种含有至少一个杂环基团的二胺衍生物与至少两种香料醛和/或酮结合而获得的。本发明的混合物能够以受控和持久的方式释放所述香料化合物，特别是香料成分，进入周围环境。本发明的动态混合物产生的正效应分布更均匀，释放的不同羰基化合物比先前报告的其他示例更好。
• 2,3-Dihydro-1H-imidazo [1.5-a]pyrroles. Condensation of Pyrroles and Formaldehyde and Primary Amines
  作者：William J. Burke、George N. Hammer

  DOI：10.1021/ja01634a028

  日期：1954.3
• US9212335B2
  申请人：——

  公开号：US9212335B2

  公开（公告）日：2015-12-15
• [EN] EQUILIBRATED DYNAMIC MIXTURES TO CONTROL THE RELEASE OF PERFUMING ALDEHYDES AND KETONES<br/>[FR] MÉLANGES DYNAMIQUES ÉQUILIBRÉS POUR CONTRÔLER LA LIBÉRATION D'ALDÉHYDES ET DE CÉTONES ODORANTS
  申请人：FIRMENICH & CIE

  公开号：WO2012139912A1

  公开（公告）日：2012-10-18

  The present invention concerns a dynamic mixture obtained by combining, in the presence of water, at least one diamine derivative, comprising at least one heteroaryl moiety, with at least two perfuming aldehydes and/or ketones. The invention's mixture is capable of releasing in a controlled and prolonged manner said perfuming compounds, in particular perfuming ingredients, into the surrounding environment. The invention's dynamic mixture gives rise to a more evenly distributed positive effect for the release of the different carbonyl compounds which are part of the mixture than other examples reported in the prior art.
• 2-Aminopyrrolyl Dilithium Compounds: Synthesis, Structural Diversity, and Catalytic Activity for Amidation of Aldehydes with Amines
  作者：Zhiqiang Guo、Qiao Liu、Xuehong Wei、Yongbin Zhang、Hongbo Tong、Jianbin Chao、Jianping Guo、Diansheng Liu

  DOI：10.1021/om4006609

  日期：2013.8.26

  Five dilithium compounds containing bidentate dianionic pyrrolyl ligands, [2-(CH3NCH2)C4H3N}Li-2(TMEDA)(3)] (1), [mu-eta(5)-2- [ CH3CH2NCH2] C4H3N]Li-2(TMEDA)}(2) (2), [Pris eta(5):eta(1)-2-[(CH3)(3)CNCH2]C4H3N]Li-2(TMEDA)}(2) (3), [eta(5)-2-[(CH3)(2)CHNCH2]C4H3N]Li-2 (TMEDA)}(2) (4), and [eta(5)-2-[(CH2)(5)CHNCH2]C4H3N1Li2(TMEDA)}(2) (5), were synthesized, and their structural features were provided. Compounds 1-5 were proved to be a series of efficient catalysts for amidation reactions of aldehydes with amines in good to excellent yields under mild conditions.