4-氯-2,4-二甲基苯丁酮 | 74298-65-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 4-氯-2,4-二甲基苯丁酮
• 英文名称: 4-chloro-1-(2,4-dimethyl-phenyl)-butan-1-one
• 英文别名: 4-chloro-2',4'-dimethylbutyrophenone；4-Chlor-1-(2,4-dimethylphenyl)-butan-1-on；γ-Chlor-2,4-dimethyl-butyrophenon；4-Chlor-2',4'-dimethylbutyrophenon；4-chloro-1-(2,4-dimethylphenyl)butan-1-one
• CAS: 74298-65-0
• 化学式: C₁₂H₁₅ClO
• 分子量: 210.704
• InChiKey: JVJAFFIEOZLZBJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

SDS

4-氯-2,4-二甲基苯丁酮MSDS英文版

反应信息

• 作为反应物：
  描述：

  4-氯-2,4-二甲基苯丁酮 在 对甲苯磺酸 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 N,N-二甲基甲酰胺 、 苯 为溶剂， 反应 30.0h， 生成 9-{3-[2-(4-dimethylphenyl)-1,3-dioxolan-2-yl]propyl}adenine
  参考文献：
  名称：

  The synthesis of ω-(2-aryl-1,3-dioxolan-2-yl)alkyl purine derivatives and their activity towards HIV reverse transcriptase

  摘要：

  Novel derivatives of 6-substituted purines were synthesized by alkylation of 6-substituted purines with various 2 -(chloroalkyl)-2 -aryl-1,3-dioxolanes and related compounds. Their inhibitory properties toward HIV reverse transcriptase were studied. The structure-activity relationship within the synthesized compounds was found.

  DOI：

  10.1134/s1068162015010069
• 作为产物：
  描述：

  间二甲苯 、 4-氯丁酰氯 在 aluminum (III) chloride 作用下， 反应 2.08h， 生成 4-氯-2,4-二甲基苯丁酮
  参考文献：
  名称：

  The synthesis of ω-(2-aryl-1,3-dioxolan-2-yl)alkyl purine derivatives and their activity towards HIV reverse transcriptase

  摘要：

  Novel derivatives of 6-substituted purines were synthesized by alkylation of 6-substituted purines with various 2 -(chloroalkyl)-2 -aryl-1,3-dioxolanes and related compounds. Their inhibitory properties toward HIV reverse transcriptase were studied. The structure-activity relationship within the synthesized compounds was found.

  DOI：

  10.1134/s1068162015010069

文献信息

• Thioketal substituted N-alkyl imidazoles
  申请人：Syntex (U.S.A.) Inc.

  公开号：US04359475A1

  公开（公告）日：1982-11-16

  Compounds of the formula: ##STR1## wherein R.sub.1 is phenyl optionally substituted with one or more substituents independently selected from the group consisting of lower alkyl, lower alkoxy, halo, or trifluoromethyl; Z is ethylene or propylene, optionally substituted with a single substituent which is lower alkyl; A is the integer 0, 1, 2, or 3; B is the integer 1, 2, or 3; and wherein the sum of A and B is 1, 2, 3 or 4; and the pharmaceutically acceptable acid addition salts thereof, said compounds being useful as spermicidal, antimicrobial and anticonvulsant agents.

  该公式化合物为：##STR1##其中R.sub.1是苯基，可选地被一个或多个取代基独立地选自以下组：低烷基，低烷氧基，卤素或三氟甲基；Z是乙烯或丙烯，可选地被一个低烷基取代；A是整数0、1、2或3；B是整数1、2或3；其中A和B的和为1、2、3或4；以及其药学上可接受的酸加盐，该化合物可用作杀精、抗微生物和抗癫痫药物。
• Agents acting on the central nervous system. XII. 3-Tert-aminopropiophenones as central muscle relaxants and diuretics
  作者：H. P. S. Chawla、B. C. Gautam、R. S. Kapil、Nitya Anand、G. K. Patnaik、Man M. Vohra、O. P. Shrivastava

  DOI：10.1021/jm00297a033

  日期：1970.5
• US4359475A
  申请人：——

  公开号：US4359475A

  公开（公告）日：1982-11-16
• The synthesis of ω-(2-aryl-1,3-dioxolan-2-yl)alkyl purine derivatives and their activity towards HIV reverse transcriptase
  作者：V. V. Komissarov、V. T. Valuev-Elliston、O. N. Ivanova、S. N. Kochetkov、A. M. Kritzyn

  DOI：10.1134/s1068162015010069

  日期：2015.1

  Novel derivatives of 6-substituted purines were synthesized by alkylation of 6-substituted purines with various 2 -(chloroalkyl)-2 -aryl-1,3-dioxolanes and related compounds. Their inhibitory properties toward HIV reverse transcriptase were studied. The structure-activity relationship within the synthesized compounds was found.