ethyl carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester | 637336-79-9

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: ethyl carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester
• 英文别名: ethylcarbamic acid (1R,2S,5R)-2-isopropyl-5-methylcyclohexyl ester；ethyl-carbamic acid-((1R)-menthyl ester)；Aethyl-carbamidsaeure-((1R)-menthylester)；Ethyl-carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester；ethyl-carbamic acid (-)-menthyl ester；[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] N-ethylcarbamate
• CAS: 637336-79-9
• 化学式: C₁₃H₂₅NO₂
• 分子量: 227.347
• InChiKey: JQFDIOKZPWALRI-GRYCIOLGSA-N

物化性质

• 沸点：
  314.4±9.0 °C(Predicted)
• 密度：
  0.95±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  十二羰基三钌 、 ethyl carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester 以 二氯甲烷 、 环己烷 为溶剂， 以34%的产率得到(μ2-H)Ru3(CO)9{μ3-η2-(1R,2S,5R)NCH2CH3COOC6H9CH(CH3)2CH3}
  参考文献：
  名称：

  Fixierung von Carbamaten, Hydraziden, Guanidinen und Isoharnstoffen an dreikernigen Rutheniumclustern. Molekülstruktur von (μ2-H)Ru3(CO)9- [μ3-η2-(1R,2S,5R)NEtCOOC16H23]

  摘要：

  Carbamates, hydrazides, guanidines und isoureae can be coordinated to the trinuclear metal framework by thermal reaction of Ru3(CO)12. While a hydrogen atom is transferred as mu-2-hydride to the ruthenium skeleton, the organic fragment binds as a tripodal handle to the three ruthenium atoms. The molecular structure of the 8-phenylmenthyl carbamato derivative (mu-2-H)Ru3(CO)9[mu-3-eta-2-(1R,2S,5R)-NEtCOOC16H23] shows an approximately isosceles Ru3 triangle with an almost symmetrically bonded hydride bridge. The Ru-Ru edge carrying the mu-2-H ligand is also bridged by the carbamato nitrogen atom, while the carbamato oxygen atom is bonded to the unbridged ruthenium atom.

  DOI：

  10.1016/0022-328x(91)86231-e
• 作为产物：
  描述：

  menthyl chloroformate 、 乙胺 在 吡啶 作用下， 以 四氢呋喃 、 甲苯 为溶剂， 反应 12.5h， 以24.4 g的产率得到ethyl carbamic acid (1R,2S,5R)-2-isopropyl-5-methyl-cyclohexyl ester
  参考文献：
  名称：

  MENTHYL CARBAMATE COMPOUNDS AS SKIN AND/OR HAIR LIGHTENING ACTIVES

  摘要：

  公开号：

  EP2593079B1

文献信息

• CYCLOHEXYL CARBAMATE COMPOUNDS AS ANTI-AGEING ACTIVES
  申请人：Küper Thomas

  公开号：US20110294876A1

  公开（公告）日：2011-12-01

  The present invention relates to the cosmetic, dermatological or therapeutic use of compounds of formula (I) given below, in particular as anti-ageing actives. wherein A denotes wherein X, Y and Z independently of one another denote hydrogen, C1-C4-alkyl or C2-C4-alkenyl, wherein optionally two of the radicals X, Y and Z are covalently bonded to one another under formation of a bicyclic ring system, in such a bicyclic ring system two of the radicals X, Y and Z together preferably form a radical having 1 to 4 carbon atoms, preferably a hydrocarbon radical having 1 to 3 carbon atoms, B denotes NR 1 R 2 , wherein R 1 denotes hydrogen or an organic radical having 1 to 14 carbon atoms, R 2 denotes an organic radical having 1 to 14 carbon atoms, and wherein optionally R 1 and R 2 are covalently bonded to one another, preferably so that B is a 3 to 8 membered ring. The invention further relates to corresponding methods and to compositions and cosmetic, dermatological or pharmaceutical preparations (compositions) comprising one or more compounds of formula (I) and one or more further anti-ageing actives. The invention further relates to compounds of formula (I) as a drug, their use for the preparation of a pharmaceutical composition and to certain novel compounds of formula (I).

  本发明涉及化妆品、皮肤学或治疗用途的化合物的使用，其化学式（I）如下，特别是作为抗衰老活性成分。其中A代表其中X、Y和Z分别表示氢、C1-C4-烷基或C2-C4-烯基，其中可选地，X、Y和Z中的两个基以形成二环戊二烯环系统的方式共价结合在一起，在这样的二环戊二烯环系统中，X、Y和Z中的两个基一起优选地形成具有1至4个碳原子的基，优选地是具有1至3个碳原子的烃基，B代表NR1R2，其中R1代表氢或具有1至14个碳原子的有机基，R2代表具有1至14个碳原子的有机基，可选地R1和R2共价结合在一起，优选地使B成为一个3至8成员环。该发明还涉及相应的方法、包含一个或多个化学式（I）化合物和一个或多个其他抗衰老活性成分的化妆品、皮肤学或药用制剂（组合物）。该发明还涉及化学式（I）化合物作为药物，它们用于制备药物组合物的用途，以及化学式（I）的某些新化合物。
• Cyclohexyl carbamate compounds as anti-ageing actives
  申请人：Symrise AG

  公开号：EP2389922A1

  公开（公告）日：2011-11-30

  The present invention relates to the cosmetic, dermatological or therapeutic use of compounds of formula (I) given below, in particular as anti-ageing actives. wherein A denotes wherein X, Y and Z independently of one another denote hydrogen, C1-C4-alkyl or C2-C4-alkenyl, wherein optionally two of the radicals X, Y and Z are covalently bonded to one another under formation of a bicyclic ring system, in such a bicyclic ring system two of the radicals X, Y and Z together preferably form a radical having 1 to 4 carbon atoms, preferably a hydrocarbon radical having 1 to 3 carbon atoms, B denotes NR1R2, wherein R1 denotes hydrogen or an organic radical having 1 to 14 carbon atoms, R2 denotes an organic radical having 1 to 14 carbon atoms, and wherein optionally R1 and R2 are covalently bonded to one another, preferably so that B is a 3 to 8 membered ring. The invention further relates to corresponding methods and to compositions and cosmetic, dermatological or pharmaceutical preparations (compositions) comprising one or more compounds of formula (I) and one or more further anti-ageing actives. The invention further relates to compounds of formula (I) as a drug, their use for the preparation of a pharmaceutical composition and to certain novel compounds of formula (I).

  本发明涉及以下式子(I)的化合物在化妆品、皮肤科或治疗中的使用，特别是作为抗衰老活性物质。 其中， A代表 其中，X、Y和Z分别独立地表示氢、C1-C4烷基或C2-C4烯基， 其中，可选地，X、Y和Z中的两个基团在形成二环环系的同时共价键合在一起，这样，在这样的二环环系中，X、Y和Z中的两个基团一起优选形成具有1到4个碳原子的基团，优选是指1到3个碳原子的碳氢基团， B代表NR1R2， 其中， R1代表氢或具有1到14个碳原子的有机基团， R2代表具有1到14个碳原子的有机基团， 并且可选地，R1和R2共价键合在一起，优选是使B成为3到8成员环。 本发明还涉及相应的方法、包含一个或多个式(I)化合物和一个或多个进一步的抗衰老活性物质的组合物和化妆品、皮肤科或制药制剂(组合物)。本发明还涉及式(I)化合物作为药物、其用于制备制药组合物以及某些新的式(I)化合物。
• Menthyl carbamate compounds as skin and/or hair lightening actives
  申请人：Vielhaber Gabriele

  公开号：US09060949B2

  公开（公告）日：2015-06-23

  The present invention relates to the cosmetic, dermatological or pharmaceutical (therapeutic) use of compounds of formula (I) or a cosmetically acceptable salt of a compound of formula (I) or a mixture containing two or more of these compounds or the salts thereof wherein R1 denotes hydrogen or an organic radical having 1 to 14 carbon atoms, R2 denotes an organic radical having 1 to 14 carbon atoms, and wherein optionally R1 and R2 are covalently bonded to one another, preferably so that a 3 to 8 membered ring is formed, for the lightening of skin and/or hair. The invention further relates to compositions and cosmetic, dermatological or pharmaceutical preparations (compositions) comprising one or more compounds of formula (I) suitable for lightening human skin and/or hair and corresponding methods. The invention further relates to compounds of formula (I) as a drug, their use for the preparation of a pharmaceutical composition for lightening human skin and/or hair and to certain novel compounds of formula (I).

  本发明涉及化妆品、皮肤科或制药（治疗）用途的化合物（I）或化合物（I）的化妆品可接受盐或含有两种或更多这些化合物或其盐的混合物，其中：R1表示氢或具有1至14个碳原子的有机基团，R2表示具有1至14个碳原子的有机基团，且可选地，R1和R2彼此共价结合，优选地形成3至8个成员环，用于美白皮肤和/或头发。本发明还涉及包含一种或多种式（I）化合物的组合物和化妆品、皮肤科或制药制剂（组合物），适用于美白人类皮肤和/或头发以及相应的方法。本发明还涉及式（I）化合物作为药物，其用于制备美白人类皮肤和/或头发的制药组合物以及某些新型式（I）化合物。
• Gastambide, Annales de Chimie (Cachan, France), 1954, vol. <12>9, p. 257,305
  作者：Gastambide

  DOI：——

  日期：——
• US9060949B2
  申请人：——

  公开号：US9060949B2

  公开（公告）日：2015-06-23