2-Bromo-1,3,4,5-tetrachlorobenzene | 139606-99-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-Bromo-1,3,4,5-tetrachlorobenzene
• CAS: 139606-99-8
• 化学式: C₆HBrCl₄
• 分子量: 294.79
• InChiKey: LNASUOMROLYDBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  0
• 氢给体数：
  0
• 氢受体数：
  0

反应信息

• 作为产物：
  描述：

  Benzene, 1,3-dibromo-2,4,5,6-tetrachloro- 、 溴苯 、 盐酸 、 水 以80%的产率得到
  参考文献：
  名称：

  HARADA, KATSUMASA;HART, H.;DU, CHI-JEN, F., J. ORG. CHEM., 1985, 50, N 26, 5524-5528

  摘要：

  DOI：

文献信息

• Photochemistry of polyhaloarenes. 12. The photochemistry of pentachlorobenzene in micellar media
  作者：Peter K. Freeman、Youn Sik Lee

  DOI：10.1021/jo00036a017

  日期：1992.5

  The dependence of the reciprocal of the quantum yield for the photohydrodechlorination of pentachlorobenzene (1) in aqueous 0.100 M hexadecyltrimethylammonium bromide (CTAB) solution upon the reciprocal of the microconcentration of 1 and upon the reciprocal of the probability for excited state 1 reacting with ground-state 1 provides a linear correlation at high microconcentrations of 1. The regiochemistry of the photohydrodechlorination process in CTAB favors formation of 1,2,4,5-tetrachlorobenzene to a significantly smaller extent than is observed in the analogous process in acetonitrile solution in the presence of triethylamine. The bromotetrachlorobenzene byproduct is formed in the photolysis in the following average composition: 1-bromo-2,3,4,5-tetrachloro- (5): 2-bromo-1,3,4,5-tetrachloro- (6): 3-bromo-1,2,4,5-tetrachlorobenzene (7) = 9.7:66.7:23.3. In a trapping experiment carried out during an irradiation of 1 in CH3CN/H2O (8:2) in the presence of excess KBr at 254 nm, bromo-tetrachlorobenzenes (5:6:7) were formed in a ratio of 11.3:66.8:21.9. These experiments are rationalized by proposing that product in these micellar photohydrodechlorination reactions is formed by fission of triplet-state 1 and a competing process which involves conversion of triplet-state 1 to triplet excimer which then undergoes fragmentation.
• Verfahren zur Formylierung von Arylhalogeniden
  申请人：BAYER AG

  公开号：EP0109606B1

  公开（公告）日：1986-01-22
• US4536344A
  申请人：——

  公开号：US4536344A

  公开（公告）日：1985-08-20
• HARADA, KATSUMASA;HART, H.;DU, CHI-JEN, F., J. ORG. CHEM., 1985, 50, N 26, 5524-5528
  作者：HARADA, KATSUMASA、HART, H.、DU, CHI-JEN, F.

  DOI：——

  日期：——