(-)-methyl trans-2,6,6-trimethyl-3-cyclohexene-1-carboxylate | 540734-24-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (-)-methyl trans-2,6,6-trimethyl-3-cyclohexene-1-carboxylate
• 英文别名: methyl (1R,2S)-2,6,6-trimethylcyclohex-3-ene-1-carboxylate
• CAS: 540734-24-5；540734-22-3
• 化学式: C₁₁H₁₈O₂
• 分子量: 182.263
• InChiKey: OENXQYZXKNBMLM-IUCAKERBSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  13
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Unsaturated ester as perfuming ingredient
  申请人：——

  公开号：US20030119712A1

  公开（公告）日：2003-06-26

  The present invention relates to a compound of formula 1 wherein R represents a methyl or an ethyl group, in the form of any one of its isomers or of a mixture thereof. The invention relates also to the use of such a compound as a perfuming ingredient capable of imparting a odorant note of the rose type. Moreover, the invention concern also the perfumed article or perfuming composition containing a compound according to the invention.

  本发明涉及一种化合物，其化学式为1，其中R代表甲基或乙基基团，可以是其任何异构体或混合物形式。本发明还涉及将此类化合物用作香料成分的用途，能够赋予玫瑰香型的气味。此外，本发明还涉及含有根据本发明的化合物的香味物品或香料组合物。
• PERFUMING NITRILES
  申请人：Winter Beat

  公开号：US20100267607A1

  公开（公告）日：2010-10-21

  The present invention relates to methods of using certain unsaturated derivatives of 2,6,6-trimethyl-cyclohexane- 1 -acetonitrile as perfuming ingredients. These compounds are valuable patchouli odorants.

  本发明涉及使用2,6,6-三甲基环己烷-1-乙腈的某些不饱和衍生物作为香料成分的方法。这些化合物是有价值的广藿香气味化合物。
• ALDEHYDES AS PERFUMING INGREDIENTS
  申请人：FIRMENICH SA

  公开号：US20150051133A1

  公开（公告）日：2015-02-19

  An aldehyde of formula (I) in the form of any one of its stereoisomers or a mixture thereof, wherein each dotted line, independently from each other, represents a single or double bond; n is 0 or 1; R 1 is a hydrogen atom or a methyl group; R 2 is a hydrogen atom or a methyl or ethyl group; and R 3 , which can be present in any of positions 2 to 6 of the cyclic moiety, is a hydrogen atom or a methyl or ethyl group, or a CH 2 group bridging positions 3 and 6. Also, the use of the aldehyde as perfuming ingredient to impart odor notes of the aldehyde, lily of the valley type.

  分子式为（I）的醛类化合物，其可为其任意立体异构体或其混合物，其中每个点线独立表示单键或双键；n为0或1；R1为氢原子或甲基基团；R2为氢原子或甲基或乙基基团；R3可以出现在环状基团的2到6位置中的任何一个，为氢原子或甲基或乙基基团，或者为桥接位置3和6的CH2基团。此外，将该醛类化合物用作香料成分，以赋予醛类、铃兰花型气味。
• Perfume ketones
  申请人：Givaudan, S.A.

  公开号：US10570080B2

  公开（公告）日：2020-02-25

  A compound of the formula (I) in which, independently, R1 is selected from H and methyl; R2 is selected from H, and methyl; R3 is selected from H, methyl and ethyl; R4 is selected from H, methyl and ethyl; or R3 and R4 together form a ring in which n is 1 or 2. The compounds have the characteristic desirable odour qualities of the Damascone® molecules, but lack their disadvantageous skin sensitization effects.

  式 (I) 的化合物 其中，独立地 R1 选自 H 和甲基 R2 选自 H 和甲基 R3 选自 H、甲基和乙基 R4 选自 H、甲基和乙基； 或 R3 和 R4 共同形成一个 n 为 1 或 2 的环。 这些化合物具有 Damascone® 分子所特有的理想气味品质，但没有皮肤过敏的缺点。
• COMPOUNDS
  申请人：Givaudan, S.A.

  公开号：US20180370890A1

  公开（公告）日：2018-12-27

  A compound of the formula (I) in which, independently, R 1 is selected from H and methyl; R 2 is selected from H, and methyl; R 3 is selected from H, methyl and ethyl; R 4 is selected from H, methyl and ethyl; or R 3 and R 4 together form a ring in which n is 1 or 2. The compounds have the characteristic desirable odour qualities of the Damascone® molecules, but lack their disadvantageous skin sensitization effects.