2-苯偶氮甲腈 2-氧化物 | 54797-20-5

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 2-苯偶氮甲腈 2-氧化物
• 中文别名: 2-苯偶氮甲腈2-氧化物
• 英文名称: N-Phenyl-N'-cyanodiazene N-oxide
• 英文别名: phenyl-ONN-azoxycyanide；Benzol-ONN-azoxycyanid；Phenyl-azoxy-cyanid；Phenylazoxycyanid；Phenylazoxycyanide；cyanoimino-oxido-phenylazanium
• CAS: 54797-20-5；132872-21-0
• 化学式: C₇H₅N₃O
• 分子量: 147.136
• InChiKey: IIYWDRMGBBSUQS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  64.9
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-苯偶氮甲腈 2-氧化物 在 盐酸 、 水 作用下， 以 四氢呋喃 为溶剂， 反应 0.33h， 生成 benzene-ONN-azoxycarboxyamide
  参考文献：
  名称：

  Fruttero; Calvino; Di Stilo, Pharmazie, 1988, vol. 43, # 7, p. 499 - 500

  摘要：

  DOI：
• 作为产物：
  描述：

  氰胺 、 亚硝基苯 在 碘苯二乙酸 作用下， 以 二氯甲烷 为溶剂， 反应 0.5h， 以95%的产率得到2-苯偶氮甲腈 2-氧化物
  参考文献：
  名称：

  烷基的定向合成，芳基，杂芳基-和ONN -azoxycyanides

  摘要：

  各种R-的ONN -azoxycyanides可以从亚硝基衍生物与氨腈和（二乙酰氧基碘）苯高产率来制备。

  DOI：

  10.1039/c39840000323

文献信息

• Process for the preparation of biocidal compounds
  申请人：SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V.

  公开号：EP0518439A2

  公开（公告）日：1992-12-16

  A process for the preparation of a compound of general formula    wherein X represents a cyano group, a group -COOH or a salt, ester or amido derivative thereof, R¹ represents a hydrogen atom or an optionally substituted alkyl group, R² represents an optionally substituted alkyl or phenyl group, Z represents an alkyl group or a halogen atom and n represents 0, 1, 2, 3 or 4, the process comprising reacting a compound of general formula    with a first reactant capable of both dehydrating the amide group of said compound of general formula IV, to form a group X wherein X represents a cyano group, and reacting with the carboxy group of said compound of general formula IV to form a group with which a compound of general formula R¹R²NH may react; subsequently reacting the resulting compound with a compound of general formula R¹R²NH to form a compound of general formula III wherein X represents a cyano group; and optionally derivatising that compound to form other compounds of general formula III, is disclosed.

  一种通式化合物的制备方法 其中 X 代表氰基、基团-COOH 或其盐、酯或氨基衍生物，R¹ 代表氢原子或任选取代的烷基，R² 代表任选取代的烷基或苯基，Z 代表烷基或卤素原子，n 代表 0、1、2、3 或 4，该工艺包括使通式化合物发生反应 与能使通式 IV 所述化合物的酰胺基脱水以形成基团 X（其中 X 代表氰基）并与通式 IV 所述化合物的羧基反应以形成可与通式 R¹R²NH 的化合物反应的基团的第一反应物反应；随后将所得化合物与通式 R¹R²NH 的化合物反应以形成通式 III 的化合物（其中 X 代表氰基）；并任选衍生该化合物以形成通式 III 的其他化合物。
• New regiospecific methods for the synthesis of N?-cyanodiazene N-oxides
  作者：S. G. Zlotin、N. V. Airapetova、E. A. Vinogradova、A. I. Podgurskii、Yu. A. Strelenko、O. A. Luk'yanov

  DOI：10.1007/bf01184538

  日期：1990.12

  New regiospecific methods have been developed for the synthesis of aliphatic, aromatic, and heterocyclic N'-cyanodiazene N-oxides based on the reactions of nitroso compounds with a system containing the sodium salt of cyanamide and tert-butyl hypochlorite and with a system containing cyanamide and dibromoiocyanurate.
• N?-(?-acetoximinoalkyl)diazene-N-oxides and some of their transformations
  作者：O. A. Luk'yanov、Yu. B. Salamonov、A. G. Bass、Yu. A. Strelenko

  DOI：10.1007/bf00959638

  日期：1991.1

  Nitroso compounds of the aromatic and aliphatic series react with O-acetylalkanoylamidoximes in the presence of dibromoisocyanurate, forming the previously unknown N'-(alpha-acetoximinoalkyl)diazene-N-oxides, which under gaseous NH3 or oxalic acid in methanol lose the acetyl group and as a result are transformed into the previously unknown N'-(alpha-hydroximinoalkyl)diazene-N-oxides.
• Chemical properties of N'-cyanodiazene N-oxides. Reactions involving the nitrile group
  作者：S. G. Zlotin、A. I. Podgurskii、N. V. Airapetova、O. A. Luk'yanov

  DOI：10.1007/bf00961253

  日期：1991.7

  The reactivity of the nitrile group in N'-cyanodiazene N-oxides has been examined for the first time. A general approach to the synthesis of nitrogenous functional derivatives of azoxycarboxylic acids by reaction of N'-cyanodiazene N-oxides with nucleophiles (water, alcohol, and hydroxylamine) is described. A method of synthesis of novel azoxy-1,2,4-oxadiazoles and tetrazoles has been developed in which aliphatic, aromatic, or heterocyclic N'-cyanodiazene N-oxides are reacted with benzonitrile N-oxide or sodium azide. Trimerization of N-cyanodiazene N-oxides, catalyzed by anhydrous HCl, has given novel symm-triazines in which the heterocycle bears three diazene N-oxide groups.
• JPH05201955A
  申请人：——

  公开号：JPH05201955A

  公开（公告）日：1993-08-10