6-methyl-4-(2,2,3-trimethylcyclopentyl)hept-1-en-4-ol | 1181557-82-3

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 6-methyl-4-(2,2,3-trimethylcyclopentyl)hept-1-en-4-ol
• CAS: 1181557-82-3
• 化学式: C₁₆H₃₀O
• 分子量: 238.414
• InChiKey: ZZOAFVYNKNKPJG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  17
• 可旋转键数：
  5
• 环数：
  1.0
• 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

• Organic Compounds
  申请人：March Sebastien

  公开号：US20100331427A1

  公开（公告）日：2010-12-30

  The present invention refers to the use as flavour or fragrance of a compound of formula (I) wherein R 4 is hydrogen and the bond between C-3 and C-4 is a single bond or the dotted line together with the bond between C-3 and C-4 represents a double bond; or R 4 is methylene, forming with C-3 and C-4 a cyclopropane ring; R 3 is hydrogen, C 1 , C 2 , C 3 , C 4 , C 5 , C 6 alkyl, or C 2 , C 3 , C 4 , C 5 , C 6 alkenyl; and I) R 1 and R 2 together with the carbon atom to which they are attached form a carbonyl group; or II) R 1 is hydroxyl and R 2 is selected from C 1 , C 2 , C 3 alkyl, and C 2 , C 3 , C 4 alkenyl.

  本发明涉及一种化合物作为香精或香料的用途，其化学式为（I），其中R4为氢，并且C-3和C-4之间的键为单键或者虚线与C-3和C-4之间的键表示双键；或者R4为亚甲基，与C-3和C-4形成环丙烷环；R3为氢、C1、C2、C3、C4、C5、C6烷基或C2、C3、C4、C5、C6烯基；以及I）R1和R2与它们连接的碳原子形成羰基；或II）R1为羟基，R2选自C1、C2、C3烷基和C2、C3、C4烯基。
• ORGANIC COMPOUNDS
  申请人：Givaudan SA

  公开号：EP2252674A1

  公开（公告）日：2010-11-24
• US8445732B2
  申请人：——

  公开号：US8445732B2

  公开（公告）日：2013-05-21
• [EN] ORGANIC COMPOUNDS<br/>[FR] COMPOSÉS ORGANIQUES
  申请人：GIVAUDAN SA

  公开号：WO2009100554A1

  公开（公告）日：2009-08-20

  The present invention refers to the use as flavour or fragrance of a compound of formula (I) wherein R4 is hydrogen and the bond between C-3 and C-4 is a single bond or the dotted line together with the bond between C-3 and C-4 represents a double bond; or R4 is methylene, forming with C-3 and C-4 a cyclopropane ring; R3 is hydrogen, C1, C2, C3, C4, C5, C6 alkyl, or C2, C3, C4, C5, C6 alkenyl; and I) R1 and R2 together with the carbon atom to which they are attached form a carbonyl group; or II) R1 is hydroxyl and R2 is selected from C1, C2, C3 alkyl, and C2, C3, C4 alkenyl.