(+)-(2E)-2-[(4aR,7S,8aR)-7,8,8-trimethyloctahydronaphthalen-2(1H)-ylidene]-1-butanol | 1227945-51-8

• 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: (+)-(2E)-2-[(4aR,7S,8aR)-7,8,8-trimethyloctahydronaphthalen-2(1H)-ylidene]-1-butanol
• 英文别名: (2E)-2-[(4aR,7S,8aR)-7,8,8-trimethyl-1,3,4,4a,5,6,7,8a-octahydronaphthalen-2-ylidene]butan-1-ol
• CAS: 1227945-51-8
• 化学式: C₁₇H₃₀O
• 分子量: 250.425
• InChiKey: PDQULHSBOANVAX-WAOVGISVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

文献信息

• COMPOUNDS HAVING SANDALWOOD ODORS
  申请人：Chapuis Christian

  公开号：US20110195038A1

  公开（公告）日：2011-08-11

  Sandalwood perfuming ingredients that are 2-[perhydro-trialkyl-2-naphthalenylidene]-1-propanol or propanal derivatives of the formula wherein one dotted line represents a carbon-carbon single bond and the other a carbon-carbon single bond or double bond; X represents a CH 2 OH group or a CHO group; each R 1 represents a hydrogen atom or a methyl group; and the R 2 , taken separately, represent each a hydrogen atom or the two R 2 groups, taken together, represent a CH 2 group or a carbon-carbon double bond; and said compound is in the form of any one of its stereoisomers or a mixture thereof, along with the use of such compound(s) in perfuming compositions or articles in the perfumery industry.

  檀香香料成分是2-[过氢化三烷基-2-萘亚甲基]-1-丙醇或丙醛的衍生物，其化学式为其中一个点线表示碳-碳单键，另一个点线表示碳-碳单键或双键；X代表 OH基团或CHO基团；每个R1代表氢原子或甲基基团；R2分别取代，每个R2代表氢原子或两个R2基团共同代表CH2基团或碳-碳双键；所述化合物以其任何立体异构体或其混合物的形式存在，并且用于香料工业中的香料组合物或香料制品中。
• US8481013B2
  申请人：——

  公开号：US8481013B2

  公开（公告）日：2013-07-09
• [EN] COMPOUNDS HAVING SANDALWOOD ODORS<br/>[FR] COMPOSÉS AU PARFUM DE SANTAL
  申请人：FIRMENICH & CIE

  公开号：WO2010061316A2

  公开（公告）日：2010-06-03

  The present invention relates to some sandalwood perfuming ingredients, which are 2-[perhydro-trialkyl-2-naphthalenylidene]-1-propanol or propanal derivatives of formula wherein one dotted line represents a carbon-carbon single bond and the other a carbon- carbon single bond or double bond; X represents a CH2OH group or a CHO group; each R1 represents a hydrogen atom or a methyl group; and the R2, taken separately, represent each a hydrogen atom or the two R2 groups, taken together, represent a CH2 group or a carbon-carbon double bond; and said compound is in the form of any one of its stereoisomers or a mixture thereof. The present invention concerns the use of said compounds in the perfumery industry as well as the compositions or articles containing said compounds.