CAS 2863-98-1|4-hydrazinylbenzonitrile hydrochloride|4-Cyanophenylhydrazine hydrochloride|4-hydrazinylbenzonitrile hydrochloride|4-Hydrazinobenzonitrile hydrochloride|4-Cyanophenylhydrazine hydrochl...

基本信息

化学结构

分子式

C₇H₈ClN₃

分子量

169.61152

精确质量

169.04067495

电荷

InChI

InChI=1S/C7H7N3.ClH/c8-5-6-1-3-7(10-9)4-2-6;/h1-4,10H,9H2;1H

InChIKey

UXDLLFIRCVPPQP-UHFFFAOYSA-N

Canonic Smiles

NNc1ccc(cc1)C#N.Cl

Isomeric Smiles

N(N)c1ccc(cc1)C#N.Cl

计算属性

JChem

Acid pKa

18.89631

质子受体

质子供体

LogD (pH = 5.5)

1.0345342

LogD (pH = 7.4)

1.2180617

Log P

1.2209846

摩尔折射率

41.4863

极化性

14.718853

极化表面积

61.84

可自由旋转的化学键

里宾斯基五规则

true

数据来源

名称和标识

IUPAC标准名

4-hydrazinylbenzonitrile hydrochloride

别名

4-Cyanophenylhydrazine hydrochloride4-Hydrazinobenzonitrile hydrochloride4-Cyanophenylhydrazine hydrochloride4-氰基苯肼盐酸盐4-肼基苯甲腈盐酸盐4-Cyanophenylhydrazine hydrochloride4-Hydrazinobenzonitrile hydrochloride4-氰基苯肼盐酸盐4-Hydrazinylbenzonitrile Hydrochloride4-(Hydrazino)benzonitrile Hydrochloride

IUPAC传统名

4-hydrazinylbenzonitrile hydrochloride

名称和标识

数据登录号

PubChem CID

PubChem SID

CAS号

MDL号