6-氯己-2-炔酸 | 89466-68-2

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 中文名称: 6-氯己-2-炔酸
• 英文名称: 6-chlorohex-2-ynoic acid
• 英文别名: 6-chloro-2-hexynoic acid ethyl ester；5-Chlor-pentin-(1)-carbonsaeure-(1)；6-Chlor-hexin-(2)-saeure-(1)；6-Chlor-hexin-(2)-saeure；6-Chlor-hex-2-insaeure
• CAS: 89466-68-2
• 化学式: C₆H₇ClO₂
• mdl: MFCD19228618
• 分子量: 146.573
• InChiKey: FZOMTCYLSQXZIB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  9
• 可旋转键数：
  2
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  37.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  6-氯己-2-炔酸 在 镍 氢气 、 sodium iodide 作用下， 以 乙醇 、 丙酮 为溶剂， 生成 6-碘己酸
  参考文献：
  名称：

  Olomucki,M., Bulletin de la Societe Chimique de France, 1963, p. 2067 - 2074

  摘要：

  DOI：
• 作为产物：
  描述：

  5-氯戊炔 、 二氧化碳 在 caesium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 60.0 ℃ 、101.33 kPa 条件下， 反应 14.0h， 以88%的产率得到6-氯己-2-炔酸
  参考文献：
  名称：

  Aher, Ravindra D.; Gade, Madhuri H.; Reddy, R. Santhosh, Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical and Analytical, 2012, vol. 51, # 9-10, p. 1325 - 1329,5

  摘要：

  DOI：

文献信息

• PROCESS FOR PREPARATION OF ALKYNYL CARBOXYLIC ACIDS
  申请人：COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH

  公开号：US20150025269A1

  公开（公告）日：2015-01-22

  The invention provides a simple, efficient, environmental friendly catalytic system for the direct carboxylation reaction using CO 2 under mild condition. A single step heterogeneous catalytic process for preparation of alkynyl carboxylic acids of formula I is disclosed.

  该发明提供了一种简单、高效、环保的催化体系，可在温和条件下利用二氧化碳进行直接羧化反应。揭示了一种用于制备式I的炔基羧酸的单步异质催化过程。
• [EN] HETEROCYCLIC SUBSTITUTED 4-(AMINOMETHYL)-PIPERIDINE BENZAMIDES AS 5HT4-ANTAGONISTS<br/>[FR] 4-(AMINOMETHYL)-PIPERIDINE BENZAMIDES SUBSTITUES PAR DES HETEROCYCLES, UTILISES COMME ANTAGONISTES DES RECEPTEURS 5HT4
  申请人：JANSSEN PHARMACEUTICA NV

  公开号：WO2005003124A1

  公开（公告）日：2005-01-13

  The present invention is concerned with novel compounds of formula (I) having 5HT4-antagonistic properties. The invention further relates to methods for preparing such novel compounds, pharmaceutical compositions comprising said novel compounds as well as the use as a medicine of said compounds.

  本发明涉及具有5HT4拮抗性质的式(I)的新化合物。该发明还涉及制备这种新化合物的方法，包括这些新化合物的药用组合物以及这些化合物作为药物的用途。
• Dearomatization of Fused Arenes Using Platinum-Catalyzed Intramolecular Formation of Two CC Bonds
  作者：Tetsuro Shibuya、Keiichi Noguchi、Ken Tanaka

  DOI：10.1002/anie.201202165

  日期：2012.6.18

  The (de)aroma of success: A cationic platinum(II) complex generated in situ catalyzes dearomatization of fused arenes by forming two intramolecular CC bonds (see scheme). Mechanistic studies reveal that this reaction could proceed through alkyne activation by the cationic platinum(II) complex followed by a Friedel–Crafts‐type reaction.

  成功的（成功）芳香：原位生成的阳离子铂（II）络合物通过形成两个分子内CC键来催化熔融芳烃的脱芳香化作用（请参见方案）。机理研究表明，该反应可能通过阳离子铂（II）络合物的炔烃活化反应，然后发生弗里德尔-克拉夫茨型反应进行。
• COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE
  申请人：Flagship Pioneering Innovations V, Inc.

  公开号：US20210289794A1

  公开（公告）日：2021-09-23

  The invention comprises methods for decreasing colonization by a bacterium of a gut of a stink bug, the method comprising providing a composition comprising vanillin or an analog thereof; and delivering said composition to an egg from which the stink bug will hatch, whereby colonization by the bacterium within the gut of the stink bug hatched from the egg treated with the composition is decreased relative to a stink bug hatched from an untreated egg. In some embodiments, the decrease in colonization by the bacterium decreases the fitness of the stink bug, e.g., decreases reproductive ability, survival, rate of development, number of eggs, number of hatched eggs, adult emergence rate, body length, body width, body mass, or cuticle thickness. In some embodiments of the methods herein, the bacterial colonization-disrupting agent is an inhibitor of bacterial metabolism. In some embodiments, the bacterial colonization-disrupting agent is a polyhydroxyalkanoate (PHA) synthesis inhibitor.
• US9302970B2
  申请人：——

  公开号：US9302970B2

  公开（公告）日：2016-04-05