N-p-nitrophenylbenzohydrazonoyl bromide | 962-13-0

• 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: N-p-nitrophenylbenzohydrazonoyl bromide
• 英文别名: Benz-<4-nitro-phenylhydrazid>-bromid；N-(p-Nitrophenyl)-benzhydrazin-bromid；Benzoyl bromide 4-nitrophenylhydrazone；(Z)-N-(4-nitrophenyl)benzenecarbohydrazonoyl bromide
• CAS: 962-13-0
• 化学式: C₁₃H₁₀BrN₃O₂
• 分子量: 320.145
• InChiKey: BNXSRUVQYMMQEZ-SSZFMOIBSA-N

物化性质

• 熔点：
  179-181 °C(Solv: isopropanol (67-63-0))
• 沸点：
  437.3±47.0 °C(Predicted)
• 密度：
  1.50±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  70.2
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 海关编码：
  2928000090

反应信息

• 作为反应物：
  描述：

  N-p-nitrophenylbenzohydrazonoyl bromide 在 sodium hydroxide 作用下， 以 乙醇 、 水 为溶剂， 反应 7.5h， 生成
  参考文献：
  名称：

  Abdelhamid, Abdou O., Journal of Chemical Research, Miniprint, 1993, # 6, p. 1239 - 1262

  摘要：

  DOI：
• 作为产物：
  描述：

  benzaldehyde p-nitrophenylhydrazone 、 溴 生成 N-p-nitrophenylbenzohydrazonoyl bromide
  参考文献：
  名称：

  PLENKIEWICZ J., POL. J. CHEM., 1979, 53, NO 2, 521-524

  摘要：

  DOI：

文献信息

• Regioselective Synthesis of Novel 4,4′-and 5,5′-bi-(1,2,4-triazole) Derivatives
  作者：Ahmad M. Farag、Kamal M. Dawood、Nabila A. Khedr

  DOI：10.3184/030823407x237876

  日期：2007.8

  A regioselective synthesis is reported of a series of polysubstituted 1,2,4-triazoles and 4,4′- and 5,5′-bi-(1,2,4-triazoles) via 1,3-dipolar cycloaddition reactions of nitrilimines with some aza- and diaza-butadiene derivatives.

  报告了一系列多取代的 1,2,4-三唑以及 4,4′- 和 5,5′- 双（1,2,4-三唑）的区域选择性合成，这些合成是通过氮亚胺与一些氮杂和重氮丁二烯衍生物的 1,3-二极环加成反应实现的。
• An efficient entry to perfluoroalkyl substituted azoles starting from β-perfluoroalkyl-β-dicarbonyl compounds
  作者：Pierfrancesco Bravo、Dario Diliddo、Giuseppe Resnati

  DOI：10.1016/s0040-4020(01)85356-4

  日期：1994.1

  5-Perfluoroalkylpyrazoles 6, 5-perfluoroalkylisoxazoles 11, and 4-perfluoroacylisoxazoles 13 are obtained in high chemical yields and complete site and regioselectivity through the reaction of beta-perfluoroalkyl-beta-dicarbonyls 2 with hydrazonyl halides 1 and halooximes 8 in the presence of bases.
• Synthesis of a new series of 4-chloro-2-mercapto-5-methylbenzenesulfonamide derivatives with potential antitumor activity
  作者：Jarosław Sławiński

  DOI：10.1016/j.ejmech.2003.09.013

  日期：2004.2

  The syntheses of S-(5-chloro-4-methyl-2-sulfamoylptienyl)alkanethio (or benzothio)hydrazonates (3a-3o) and potassium S-(5-chloro-2-cyanoamidatesulfonyl-4-methylphenyl)alkanethio (or benzothio)hydrazonates (4-10) are described. The compounds 3e, 3i-3o, 7 and 8 were screened at the National Cancer Institute (NCI) for their activities against a panel of 59 tumor cell lines and relationships between Structure and antitumor activity in vitro are discussed. The Compounds 3e, 3j, 3l-3o and 7 exhibited reasonable activity against numerous human tumor cell lines. The prominent compound 3l showed significant activity against some cell lines of leukemia (SR), melanoma (SK-MEL-5), CNS cancer (SF-539), ovarian cancer (OVCAR-3, OVCAR-4) and breast cancer (MDA-MB-231/ACTT) (GI(50) values in the range, 0.3-0.9 muM). Furthermore, compound 8 exhibited the high selectivity against renal cancer (A498) cells (GI(50) < 0.01 muM, TGI = 2.3 muM and LC50 = 35.7 muM). (C) 2003 Elsevier SAS. All rights reserved.
• Butler, Richard N.; Duffy, J. Paul; McArdle, Patrick, Journal of Chemical Research, Miniprint, 1991, # 5, p. 935 - 952
  作者：Butler, Richard N.、Duffy, J. Paul、McArdle, Patrick、Cunningham, Desmond

  DOI：——

  日期：——
• BUTLER, RICHARD N.;FITZGERALD, KEVIN J., PROC. ROY. IRISH ACAD. B , 89,(1989) N-52, C. 251-257
  作者：BUTLER, RICHARD N.、FITZGERALD, KEVIN J.

  DOI：——

  日期：——