octyl cyclohex-1-enecarboxylate | 1132885-88-1

• 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: octyl cyclohex-1-enecarboxylate
• 英文别名: Octyl cyclohexene-1-carboxylate
• CAS: 1132885-88-1
• 化学式: C₁₅H₂₆O₂
• 分子量: 238.37
• InChiKey: HVSRVUAFOJYONP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  17
• 可旋转键数：
  9
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.8
• 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：

  octyl cyclohex-1-enecarboxylate 在 sodium chlorite 、 sodium dihydrogenphosphate 、 2-甲基-2-丁烯 、 臭氧 作用下， 以 二氯甲烷 、 水 、 叔丁醇 为溶剂， 反应 3.0h， 生成 1-monooctyl α-ketoheptanedioic ester
  参考文献：
  名称：

  Synthesis of the 1-Monoester of 2-Ketoalkanedioic Acids, for Example, Octyl α-Ketoglutarate

  摘要：

  Oxidative cleavage of cycloalkene-1-carboxylates, made from the corresponding carboxylic acids, and subsequent oxidation of the resulting ketoaldehyde afforded the important 1-monoesters of 2-ketoalkanedioic acids. Thus ozonolysis of octyl cyclobutene-1-carboxylate followed by sodium chlorite oxidation afforded the 1-monooctyl 2-ketoglutarate. This is a cell-permeable prodrug form of alpha-ketoglutarate, an important intermediate in the tricarboxylic acid (TCA, Krebs) cycle and a promising therapeutic agent in its own right.

  DOI：

  10.1021/jo302308q
• 作为产物：
  描述：

  辛醇 、 环己烯甲酸 在 4-二甲氨基吡啶 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 为溶剂， 反应 9.0h， 以91%的产率得到octyl cyclohex-1-enecarboxylate
  参考文献：
  名称：

  Synthesis of the 1-Monoester of 2-Ketoalkanedioic Acids, for Example, Octyl α-Ketoglutarate

  摘要：

  Oxidative cleavage of cycloalkene-1-carboxylates, made from the corresponding carboxylic acids, and subsequent oxidation of the resulting ketoaldehyde afforded the important 1-monoesters of 2-ketoalkanedioic acids. Thus ozonolysis of octyl cyclobutene-1-carboxylate followed by sodium chlorite oxidation afforded the 1-monooctyl 2-ketoglutarate. This is a cell-permeable prodrug form of alpha-ketoglutarate, an important intermediate in the tricarboxylic acid (TCA, Krebs) cycle and a promising therapeutic agent in its own right.

  DOI：

  10.1021/jo302308q

文献信息

• SILANE COUPLING AGENTS FOR FILLED RUBBERS
  申请人：BASF SE

  公开号：EP2190912B1

  公开（公告）日：2011-11-23
• US8252862B2
  申请人：——

  公开号：US8252862B2

  公开（公告）日：2012-08-28
• [EN] SILANE COUPLING AGENTS FOR FILLED RUBBERS<br/>[FR] AGENTS DE COUPLAGE SILANES POUR CAOUTCHOUCS CHARGÉS
  申请人：CIBA HOLDING INC

  公开号：WO2009034016A1

  公开（公告）日：2009-03-19

  The invention describes a composition comprising a) a naturally occurring or synthetic rubber susceptible to oxidative, thermal, dynamic, light-induced and/or ozone-induced degradation, b) a white reinforcing filler, and c) as coupling agent, at least one compound of the formula I wherein the general symbols are as defined in claim 1, or an oligomeric hydrolysis product of the compound of the formula I.
• [EN] COUPLING AGENTS FOR FILLED RUBBERS<br/>[FR] AGENTS DE COUPLAGE POUR CAOUTCHOUCS CHARGÉS
  申请人：BASF SE

  公开号：WO2010006889A2

  公开（公告）日：2010-01-21

  The invention describes a composition comprising a) a naturally occurring or synthetic rubber susceptible to oxidative, thermal, dynamic, light-induced and/or ozone-induced degradation, b) a white reinforcing filler, c) a coupling agent selected from the group consisting of organofunctionalized silanes, polysulfide silanes, blocked mercaptosilanes, thio substituted silanes, sulfoxide or sulfone substituted silane coupling agents, and oligomeric hydrolysis product thereof, and d) a coupling agent regulator selected from the group consisting of cyclic or acyclic 1,2-disubstituted alkenes bearing two electron-withdrawing groups, cyclic or acyclic 1,2-disubstituted alkenes bearing one electron-withdrawing group and one electron-donating group, cyclic or acyclic 1,1-disubstituted alkenes bearing two electron-withdrawing groups, cyclic or acyclic 1,1-disubstituted alkenes bearing one electron-withdrawing group and one electron-donating group, and cyclic or acyclic trisubstituted alkenes bearing at least two electron-withdrawing groups.
• Synthesis of the 1-Monoester of 2-Ketoalkanedioic Acids, for Example, Octyl α-Ketoglutarate
  作者：Michael E. Jung、Gang Deng

  DOI：10.1021/jo302308q

  日期：2012.12.7

  Oxidative cleavage of cycloalkene-1-carboxylates, made from the corresponding carboxylic acids, and subsequent oxidation of the resulting ketoaldehyde afforded the important 1-monoesters of 2-ketoalkanedioic acids. Thus ozonolysis of octyl cyclobutene-1-carboxylate followed by sodium chlorite oxidation afforded the 1-monooctyl 2-ketoglutarate. This is a cell-permeable prodrug form of alpha-ketoglutarate, an important intermediate in the tricarboxylic acid (TCA, Krebs) cycle and a promising therapeutic agent in its own right.