acetic acid 2,5-dimethyl-bicyclo[3.2.1]oct-2-en-3-yl ester | 1351692-47-1

• 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: acetic acid 2,5-dimethyl-bicyclo[3.2.1]oct-2-en-3-yl ester
• 英文别名: (2,5-Dimethyl-3-bicyclo[3.2.1]oct-2-enyl) acetate
• CAS: 1351692-47-1
• 化学式: C₁₂H₁₈O₂
• 分子量: 194.274
• InChiKey: QAVJRRQIMMOYLL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  2,5-dimethyl-bicyclo[3.2.1]oct-2-ene 在 过氧乙酸 、 三氟化硼乙醚 、 sodium acetate 、 对甲苯磺酸 作用下， 以 甲苯 为溶剂， 反应 24.0h， 生成 acetic acid 1,4-dimethyl-bicyclo[3.2.1]oct-2-en-3-yl ester 、 acetic acid 2,5-dimethyl-bicyclo[3.2.1]oct-2-en-3-yl ester
  参考文献：
  名称：

  3.2.1-bicyclo-octene and -octane compounds

  摘要：

  本发明涉及一种通过引入一种由下式表示的新型3.2.1-双环辛烯或辛烷化合物的恶臭对抗有效量来对抗恶臭的方法：其中R选自氢、乙酸酯、碳酸单甲酯和烯氧基的群；并且其中断线代表单键或双键。

  公开号：

  US08415391B2

文献信息

• NOVEL 3.2.1-BICYCLO-OCTENE AND -OCTANE COMPOUNDS
  申请人：Closson Adam P.

  公开号：US20120087884A1

  公开（公告）日：2012-04-12

  The present invention relates to novel compounds and their use in fragrance compositions. Novel 3.2.1-bicyclo-octene and -octane compounds of the present invention are represented by formula: wherein R is selected from the group consisting of hydrogen, acetate, carbonate monomethyl ester, and allyloxy; and wherein the broken line represents a single or double bond.

  本发明涉及新化合物及其在香精组合物中的应用。本发明的新型3.2.1-双环辛烯和辛烷化合物由以下式表示：其中R选自氢、乙酸酯、碳酸盐单甲酯和烯丙氧基等基团；其中断裂线代表单键或双键。
• Low volatile reactive malodor counteractives and methods of use thereof
  申请人：International Flavors & Fragrances Inc.

  公开号：EP2524704A2

  公开（公告）日：2012-11-21

  The present invention is a compound for counteracting thiol- and amine-based malodors in consumer, industrial and textile products.

  本发明是一种化合物，用于抵消消费品、工业品和纺织品中的硫醇和胺类恶臭。
• MALODOR COUNTERACTING COMPOSITIONS
  申请人：International Flavors & Fragrances Inc.

  公开号：EP3101171A1

  公开（公告）日：2016-12-07

  A malodor counteracting composition contains a malodor counteractant that is capable of neutralizing a malodor and a stabilizer that is capable of decreasing or preventing self-polymerization of the malodor counteractant. The malodor counteractant has a backbone and one or more reactive end groups that are covalently attached to the backbone, the backbone has a molecular weight of 100 to 50,000 Daltons, and the one or more reactive end groups each have an α,β-unsaturated carbonyl group. Also disclosed are consumer, industrial or textile products containing the malodor counteracting composition and methods of neutralizing malodor using the composition.

  一种恶臭抑制组合物含有一种能够中和恶臭的恶臭抑制剂和一种能够减少或防止恶臭抑制剂自聚合的稳定剂。恶臭抑制剂具有骨架和一个或多个共价连接到骨架上的活性末端基团，骨架的分子量为 100 至 50,000 道尔顿，一个或多个活性末端基团各自具有一个 α、β-不饱和羰基。此外，还公开了含有恶臭抑制组合物的消费品、工业品或纺织品，以及使用该组合物中和恶臭的方法。
• LOW VOLATILE REACTIVE MALODOR COUNTERACTIVES AND METHODS OF USE THEREOF
  申请人：International Flavors & Fragrances Inc.

  公开号：EP3103480A1

  公开（公告）日：2016-12-14

  The present invention is a compound for counteracting thiol- and amine-based malodors in consumer, industrial and textile products. The compound comprises an α,β-unsaturated carbonyl moiety covalently attached to an alkene oxide polymer or block or random copolymer thereof.

  本发明是一种化合物，用于抵消消费品、工业品和纺织品中的硫醇和胺类恶臭。该化合物包括一个共价连接到氧化烯聚合物或其嵌段或无规共聚物上的α、β-不饱和羰基。
• Malodor counteracting compositions
  申请人：Sasaki Takashi

  公开号：US10226544B2

  公开（公告）日：2019-03-12

  A malodor counteracting composition contains a malodor counteractant that is capable of neutralizing a malodor and a stabilizer that is capable of decreasing or preventing self-polymerization of the malodor counteractant. The malodor counteractant has a backbone and one or more reactive end groups that are covalently attached to the backbone, the backbone has a molecular weight of 100 to 50,000 Daltons, and the one or more reactive end groups each have an α,β-unsaturated carbonyl group. Also disclosed are consumer, industrial or textile products containing the malodor counteracting composition and methods of neutralizing malodor using the composition.

  一种恶臭抑制组合物含有一种能够中和恶臭的恶臭抑制剂和一种能够减少或防止恶臭抑制剂自聚合的稳定剂。恶臭抑制剂具有骨架和一个或多个共价连接到骨架上的活性末端基团，骨架的分子量为 100 至 50,000 道尔顿，一个或多个活性末端基团各自具有一个 α、β-不饱和羰基。此外，还公开了含有恶臭抑制组合物的消费品、工业品或纺织品，以及使用该组合物中和恶臭的方法。