2-methyl-2-carboxymethylcyclopentanone | 58928-85-1

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-methyl-2-carboxymethylcyclopentanone
• 英文别名: 1-methyl-2-oxocyclopentaneacetic acid；(1-methyl-2-oxo-cyclopentyl)-acetic acid；(1-Methyl-2-oxo-cyclopentyl)-essigsaeure；<1-Methyl-2-oxo-cyclopentyl>-essigsaeure；2-(1-Methyl-2-oxocyclopentyl)acetic acid
• CAS: 58928-85-1
• 化学式: C₈H₁₂O₃
• 分子量: 156.181
• InChiKey: ZWUKRWLUVHZOHP-UHFFFAOYSA-N

物化性质

• 熔点：
  68-69 °C
• 沸点：
  160 °C(Press: 10 Torr)
• 密度：
  1.149±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  54.4
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-methyl-2-carboxymethylcyclopentanone 生成 2-(1-甲基-2-氧代环戊基)乙酸乙酯
  参考文献：
  名称：

  ASSELIN A. A.; HUMBER L. G.; DOBSON T. A.; KOMLOSSY J.; MARTEL R. R., J. MED. CHEM. , 1976, 19, NO 6, 787-792

  摘要：

  DOI：
• 作为产物：
  描述：

  2-烯丙基-2-甲基环戊酮 在 ruthenium(IV) oxide 、 sodium periodate 作用下， 以 四氯化碳 、 丙酮 为溶剂， 生成 2-methyl-2-carboxymethylcyclopentanone
  参考文献：
  名称：

  Cycloalkanoindoles. 1. Syntheses and antiinflammatory actions of some acidic tetrahydrocarbazoles, cyclopentindoles, and cycloheptindoles

  摘要：

  A novel series of acidic cycloalkanoindoles comprising tetrahydrocarbazole-, cyclopentindole-, and cycloheptindole-1-acetic acids has been synthesized via the Fischer indolization between a phenylhydrazine and a 1-alkyl-2-oxocycloalkaneacetic acid ester. These compounds were evaluated, orally, for their capacities to decrease estabished adjuvant arthritis in rats. The most active compound of the series was 1-ethyl-8-n-propyl-1,2,3,4-tetrahydrocarbazole-1-acetic acid (AY-24 873),which had an ED50 of 1.1 +/- 0.2 mg/kg. AY-24 873 was also studied orally in rats for its effect on the acute inflammatory response in the carrageenin paw edema test. It was found that AY-24 873 was about ten times more active against the chromic than against the acute models of inflammation used.

  DOI：

  10.1021/jm00228a010

文献信息

• COLD-SETTING COMPOSITION
  申请人：THREE BOND CO., LTD.

  公开号：EP1298169A1

  公开（公告）日：2003-04-02

  The invention provides a room-temperature-curing composition which comprises (A) a polymer ingredient comprising a copolymer (A1) which contains a silicon having a hydrolyzable functional group and has a molecular chain substantially comprising (a) alkyl (meth)acrylate monomer units having an alkyl group having 1 to 8 carbon atoms and (b) alkyl (meth)acrylate monomer units having an alkyl group having 10 to 30 carbon atoms, (B) a moisture curing catalyst, and (C) any of the following (C1) to (C3): (C1) a metal salt hydrate; (C2) a primary amine compound (C2a) and a compound having a carbonyl groups (C2b); and (C3) an inorganic filler surface-treated with a silicate. The room-temperature-curing composition of the invention is excellent in rapid curing property, depth curability, and workability.

  本发明提供了一种室温固化组合物，该组合物包括(A)聚合物成分，该聚合物成分包括一种共聚物(A1)，该共聚物含有一种具有可水解官能团的硅，其分子链基本上包括(a)具有1至8个碳原子的烷基的烷基(甲基)丙烯酸酯单体单元和(b)具有10至30个碳原子的烷基的烷基(甲基)丙烯酸酯单体单元；(B)湿气固化催化剂；以及(C)以下(C1)至(C3)中的任何一种：(C1) 金属盐水合物；(C2) 伯胺化合物 (C2a) 和具有羰基的化合物 (C2b)；以及 (C3) 经硅酸盐表面处理的无机填料。本发明的室温固化组合物具有优异的快速固化性能、深度固化性能和可加工性。
• Cold-setting composition
  申请人：——

  公开号：US20030149152A1

  公开（公告）日：2003-08-07

  The invention provides a room-temperature-curing composition which comprises (A) a polymer ingredient comprising a copolymer (A1) which contains a silicon having a hydrolyzable functional group and has a molecular chain substantially comprising (a) alkyl (meth)acrylate monomer units having an alkyl group having 1 to 8 carbon atoms and (b) alkyl (meth)acrylate monomer units having an alkyl group having 10 to 30 carbon atoms, (B) a moisture curing catalyst, and (C) any of the following (C1) to (C3): (C1) a metal salt hydrate; (C2) a primary amine compound (C2a) and a compound having a carbonyl groups (C2b); and (C3) an inorganic filler surface-treated with a silicate. The room-temperature-curing composition of the invention is excellent in rapid curing property, depth curability, and workability.

  本发明提供了一种室温固化组合物，该组合物包括(A)聚合物成分，该聚合物成分包括一种共聚物(A1)，该共聚物含有一种具有可水解官能团的硅，其分子链基本上包括(a)具有1至8个碳原子的烷基的烷基(甲基)丙烯酸酯单体单元和(b)具有10至30个碳原子的烷基的烷基(甲基)丙烯酸酯单体单元；(B)湿气固化催化剂；以及(C)以下(C1)至(C3)中的任何一种：(C1) 金属盐水合物；(C2) 伯胺化合物 (C2a) 和具有羰基的化合物 (C2b)；以及 (C3) 经硅酸盐表面处理的无机填料。本发明的室温固化组合物具有优异的快速固化性能、深度固化性能和可加工性。
• Buchta et al., Chemische Berichte, 1958, vol. 91, p. 1552,1553
  作者：Buchta et al.

  DOI：——

  日期：——
• Chakravarty; Banerjee, Journal of the Indian Chemical Society, 1946, vol. 23, p. 377
  作者：Chakravarty、Banerjee

  DOI：——

  日期：——
• Palladium-Catalyzed Enantioselective Decarboxylative Allylic Alkylation of Cyclopentanones
  作者：Robert A. Craig、Steven A. Loskot、Justin T. Mohr、Douglas C. Behenna、Andrew M. Harned、Brian M. Stoltz

  DOI：10.1021/acs.orglett.5b02376

  日期：2015.11.6

  The first general method for the enantioselective construction of all-carbon quaternary centers on cyclopentanones by enantioselective palladium-catalyzed decarboxylative allylic alkylation is described. Employing the electronically modified (S)-(p-CF3)(3)-t-BuPHOX ligand, alpha-quaternary cyclopentanones were isolated in yields up to >99% with ee's up to 94%. Additionally, in order to facilitate large-scale application of this method, a low catalyst loading protocol was employed, using as little as 0.15 mol % Pd, furnishing the product without any loss in ee.