1-(4a,8-dimethyl-4,5,6,7,8,8a-hexahydro-3H-naphthalen-2-yl)ethanone

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(4a,8-dimethyl-4,5,6,7,8,8a-hexahydro-3H-naphthalen-2-yl)ethanone
• 化学式: C₁₄H₂₂O
• 分子量: 206.32
• InChiKey: JCRUIJVNHASLIE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.79
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

文献信息

• Vetiver odorant
  申请人：Firmenich SA

  公开号：US10787627B2

  公开（公告）日：2020-09-29

  The present invention relates to trans isomers of formula (I) in the form of any one of its stereoisomers or a mixture thereof, and wherein the bold and hatched lines indicate a relative or absolute configuration; and one dotted line represents a carbon-carbon single bond and the other a carbon-carbon double bond; and their uses as perfuming ingredients (e.g. to impart vetiver/rooty notes), e.g. in consumer products.

  本发明涉及式 (I) 的反式异构体 式（I）的反式异构体，其形式为任意一种立体异构体或其混合物，其中粗线和斜线表示相对构型或绝对构型；一条虚线表示碳碳单键，另一条虚线表示碳碳双键； 以及它们作为香水成分的用途（如赋予香根草/根茎香调），例如在消费品中的用途。
• VETIVER ODORANT
  申请人：Firmenich SA

  公开号：EP3356502A1

  公开（公告）日：2018-08-08
• [EN] VETIVER ODORANT<br/>[FR] PARFUM DE VÉTIVER
  申请人：FIRMENICH & CIE

  公开号：WO2018185010A1

  公开（公告）日：2018-10-11

  The present invention relates to compound of formula (I) in the form of any one of its stereoisomers or a mixture thereof, and wherein the dotted lines represent a carbon-carbon single bond or a carbon-carbon a double bond; and one R1 group represents a hydrogen atom and the second R1 group represents a methyl group; and their uses as perfuming ingredients to impart vetiver/rooty and powdery notes e.g. in perfuming compositions or in consumer products.