2-methyl-6-bromo-3-hexanone | 76367-86-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-methyl-6-bromo-3-hexanone
• 英文别名: 6-bromo-2-methylhexan-3-one
• CAS: 76367-86-7
• 化学式: C₇H₁₃BrO
• 分子量: 193.084
• InChiKey: LHMIENLVIMKCNL-UHFFFAOYSA-N

物化性质

• 沸点：
  213.3±23.0 °C(Predicted)
• 密度：
  1.247±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为反应物：
  描述：

  2-methyl-6-bromo-3-hexanone 在 盐酸 、 sodium cyanoborohydride 、 肼 作用下， 以 甲醇 、 乙醇 、 N,N-二甲基甲酰胺 为溶剂， 反应 196.0h， 生成 6-methoxy-4-methyl-8-<<1-(1-methylethyl)-4-aminobutyl>amino>quinoline
  参考文献：
  名称：

  Synthesis and antimalarial activity of 8-[(1-alkyl-4-aminobutyl)amino]-6-methoxy-4-methylquinolines

  摘要：

  Three analogues of the causal prophylactic antimalarial primaquine were prepared and their antimalarial activity was evaluated. 8-[(1-Ethyl-4-aminobutyl)amino]-6-methoxy-4-methylquinoline (2a) demonstrated activity against Plasmodium berghei in mice at 20 mg/kg, with all animals cured at 320 mg/kg, and is without toxicity at 640 mg/kg. It also possessed outstanding causal prophylactic activity against Plasmodium cynomolgi in rhesus monkeys at very low dosages.

  DOI：

  10.1021/jm00134a019
• 作为产物：
  描述：

  1-环丙基-2-甲基丙烷-1-酮 在 氢溴酸 作用下， 反应 24.0h， 生成 2-methyl-6-bromo-3-hexanone
  参考文献：
  名称：

  Synthesis and antimalarial activity of 8-[(1-alkyl-4-aminobutyl)amino]-6-methoxy-4-methylquinolines

  摘要：

  Three analogues of the causal prophylactic antimalarial primaquine were prepared and their antimalarial activity was evaluated. 8-[(1-Ethyl-4-aminobutyl)amino]-6-methoxy-4-methylquinoline (2a) demonstrated activity against Plasmodium berghei in mice at 20 mg/kg, with all animals cured at 320 mg/kg, and is without toxicity at 640 mg/kg. It also possessed outstanding causal prophylactic activity against Plasmodium cynomolgi in rhesus monkeys at very low dosages.

  DOI：

  10.1021/jm00134a019

文献信息

• Polivin, Yu. N.; Karakhanov, R. A.; Sheveleva, T. S., Journal of Organic Chemistry USSR (English Translation), 1992, vol. 28, # 4.2, p. 672
  作者：Polivin, Yu. N.、Karakhanov, R. A.、Sheveleva, T. S.、Sorokina, E. V.

  DOI：——

  日期：——
• YAN SHOU-JEN; CHIEN PING-LU; CHENG C. C., J. MED. CHEM.,1981, 24, NO 2, 215-217
  作者：YAN SHOU-JEN、 CHIEN PING-LU、 CHENG C. C.

  DOI：——

  日期：——
• a4B7 INTEGRIN THIOETHER PEPTIDE ANTAGONISTS
  申请人：Protagonist Therapeutics, Inc.

  公开号：US20160031944A1

  公开（公告）日：2016-02-04

  The invention relates to thioether monomer and dimer peptide molecules which inhibit binding of α4β7 to the mucosal addressing cell adhesion molecule (MAdCAM) in vivo.
• NOVEL a4B7 THIOETHER PEPTIDE DIMER ANTAGONISTS
  申请人：Protagonist Therapeutics, Inc.

  公开号：US20180099995A1

  公开（公告）日：2018-04-12

  The invention relates to thioether monomer and dimer peptide molecules which inhibit binding of α4β7 to the mucosal addressing cell adhesion molecule (MAdCAM) in vivo.
• US9714270B2
  申请人：——

  公开号：US9714270B2

  公开（公告）日：2017-07-25