cis-cyclohexylbutyric acid ethyl ester | 2511-26-4

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: cis-cyclohexylbutyric acid ethyl ester
• 英文别名: Ethyl 2-cyclohexylbutanoate
• CAS: 2511-26-4
• 化学式: C₁₂H₂₂O₂
• 分子量: 198.305
• InChiKey: LYOORHKVMBWDGN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  14
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  cis-cyclohexylbutyric acid ethyl ester 在 二异丁基氢化铝 、 potassium carbonate 作用下， 以 甲醇 、 二氯甲烷 、 甲苯 为溶剂， 生成 Cis-4-[4-(N-Benzyl-N-methylamino)cyclohexyl]butan-1-ol Hydrogen Oxalate
  参考文献：
  名称：

  Aminocyclohexane derivatives as 5-HT receptor agonists

  摘要：

  一类取代氨基环己烷衍生物是5-HT1样受体的选择性激动剂，是人类5-HT1D&agr;受体亚型的有效激动剂，同时相对于5-HT1D&bgr;亚型至少具有10倍的选择性亲和力；因此，在治疗和/或预防特定临床病症，尤其是偏头痛及相关疾病方面，对5-HT1D受体的亚型选择性激动剂具有明确指示的情况下，它们是有用的，而且引起的副作用较少，尤其是与非亚型选择性5-HT1D受体激动剂相关的不良心血管事件。

  公开号：

  US06211219B1
• 作为产物：
  描述：

  ((1R,2R)-2-chlorocyclohexyl)(phenyl)sulfane 在 zinc dibromide 镍 作用下， 以 二氯甲烷 、 丙酮 为溶剂， 反应 19.0h， 生成 cis-cyclohexylbutyric acid ethyl ester
  参考文献：
  名称：

  O-silylated enolates in organic synthesis: sulphur-mediated alkylation of esters with alkenes.

  摘要：

  DOI：

  10.1016/s0040-4039(00)81644-5

文献信息

• Use of low molecular weight acetal, alcohol, acylated alcohol and ester compounds to block or reduce odor of carboxylic acids
  申请人：Senomyx, Inc.

  公开号：US20030089885A1

  公开（公告）日：2003-05-15

  Low molecular weight acetal, alcohol, O-acylated alcohol and ester compounds are identified that block the odor of specific carboxylic acids especially propionic acid, butyric acid, isovaleric acid 3-methyl-2-hexenoic acid and hexanoic acid. These compounds exhibit surprisingly high odor blocking properties and are therefore useful additives to compositions such as: a) personal care products including underarm deodorant and antiperspirant, hair shampoo and conditioner, toilet soap, and skin lotion; b) fabric care products including laundry detergents, fabric conditioners, and fabric fresheners; c) pet care products including deodorant, shampoo, conditioner, and d) home care products including air fresheners, carpet fresheners, surface cleaners and hand wash dish detergent.

  识别出低分子量的缩醛、醇、O-酰化醇和酯类化合物，可以阻止特定羧酸的气味，特别是丙酸、丁酸、异戊酸、3-甲基-2-己烯酸和己酸。这些化合物表现出惊人的高气味阻断性能，因此可作为以下配方的有用添加剂：a）个人护理产品，包括腋下除臭剂和止汗剂、洗发水和护发素、香皂和皮肤乳液；b）织物护理产品，包括洗衣液、织物柔顺剂和织物清新剂；c）宠物护理产品，包括除臭剂、洗发水、护发素；d）家居护理产品，包括空气清新剂、地毯清新剂、表面清洁剂和手洗碗清洁剂。
• Malodor counteractant compositions and methods for preparing and using same
  申请人：Bush Boake Allen Inc.

  公开号：EP1167507A2

  公开（公告）日：2002-01-02

  This invention pertains to a method of counteracting a malodor in a solid or liquid, soap or detergent caused by a compound selected from the group consisting of lower carboxylic acids, thiols, thiophenols, phenols, lower amines, phosphines, arsines, lower alcohols, and lower ketones. The method comprises introducing into the solid or liquid, soap or detergent an effective malodor counteracting amount of a malodor counteracting compound selected from the group consisting of 1-cyclohexyl-ethyl-butyrate, 1-cyclohexyl-ethyl-acetate, 1-cyclohexyl-ethanol, 4-isopropyl-cyclohexyl-propionate, and phenoxyacetic acid 2-hydroxy-ethyl ester. The perceived total odor intensity in the solid or liquid, soap or detergent is reduced and the perceived malodor intensity in the solid or liquid, soap or detergent is substantially eliminated. The malodor counteractant compositions may be used in a wide variety of solid or liquid, soaps or detergents.

  本发明涉及一种抵消固体或液体、肥皂或洗涤剂中由选自低级羧酸、硫醇、噻吩酚、酚、低级胺、膦、砷化氢、低级醇和低级酮组成的组的化合物引起的恶臭的方法。该方法包括在固体或液体、肥皂或洗涤剂中引入有效量的恶臭抑制化合物，该化合物选自 1-环己基-乙基-丁酸酯、1-环己基-乙基-乙酸酯、1-环己基-乙醇、4-异丙基-环己基-丙酸酯和苯氧乙酸 2-羟基-乙酯组成的组。固体或液体、肥皂或洗涤剂中的总气味强度会降低，固体或液体、肥皂或洗涤剂中的恶臭强度也会基本消除。恶臭抑制剂组合物可用于各种固体或液体、肥皂或洗涤剂中。
• Cyclohexylethan-1-yl ester mixtures as malodour counteractants and methods for using same
  申请人：INTERNATIONAL FLAVORS & FRAGRANCES INC.

  公开号：EP1447102A1

  公开（公告）日：2004-08-18

  Described is an ester mixture consisting essentially of 1-cyclohexylethan-1-yl butyrate and 1-cyclohexylethan-1-yl acetate wherein the weight ratio of 1-cyclohexylethan-1-yl butyrate: 1-cyclohexylethan-1-yl acetate is from about 20:80 up to about 80:20. The mixture is synergistically effective for its ability to counteract a malodour (1) emanating from a malodourous solid or liquid source into a 3-space proximate the solid or liquid source or (2) present in a malodourous air 3-space.

  所述的酯混合物主要由丁酸 1-环己基乙烷-1-基酯和乙酸 1-环己基乙烷-1-基酯组成，其中丁酸 1-环己基乙烷-1-基酯的重量比为约 20:80，乙酸 1-环己基乙烷-1-基酯的重量比为约 80:20：1-环己基乙烷-1-基乙酸酯的重量比从约 20:80 到约 80:20。该混合物具有协同增效作用，可有效抵消以下恶臭：(1) 从恶臭固体或液体源散发到靠近固体或液体源的三维空间中的恶臭，或 (2) 存在于恶臭空气三维空间中的恶臭。
• Fragrance composition
  申请人：Quellet Christian

  公开号：US10004205B2

  公开（公告）日：2018-06-26

  A solid, free-flowing composition adapted to deliver fragrance or malodor counteractant in a consumer product that is subjected to actual or potential malodorous influences, comprising: a delivery system consisting of a core material surrounded by a fragranced material comprising microdroplets of a dispersed fragrance in a fragrance-encapsulating material, optionally surrounded by a protective coating, and, an external absorbent material in which the fragrance delivery vehicle is dispersed. The invention is especially effective with respect to animal litters, especially those for cats.

  一种固态、自由流动的组合物，适用于在受到实际或潜在恶臭影响的消费品中提供香味或恶臭抑制剂，包括 一种输送系统，由核心材料和香味材料组成，香味材料包括香味胶囊材料中的分散香味微滴，可选择在其周围包裹一层保护膜、 以及 外部吸收材料，香味输送载体分散在其中。 本发明对动物，尤其是猫用猫厕所特别有效。
• Scented paints, paint scenting additive mixtures and processes for producing scented paints
  申请人：Scentco, LLC.

  公开号：US20030232901A1

  公开（公告）日：2003-12-18

  Disclosed are paint scenting additive mixtures formulated to be introduced into paint compositions as a stable dispersion therein to produce a scented paint which provides a pleasant and long-lasting fragrance or aroma in an ambient surrounding where the scented paint is applied as well as processes for producing scented paints utilizing such additive mixtures and the scented products produced therewith.

  本发明公开了涂料香味添加剂混合物，该混合物经配制可作为稳定的分散体引入涂料组合物中，以生产出香味涂料，在涂抹该香味涂料的周围环境中提供令人愉悦的持久香味或芳香，还公开了利用这种添加剂混合物生产香味涂料的工艺以及用其生产的香味产品。