CAS 61-76-7|L-PHENYLEPHRINE HYDROCHLORIDE|phenylephrine hydrochloride|3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol hydrochloride|Phenylephrine hydrochloride|L-PHENYLEPHRINE HYDROCHLORIDE USP GRADE|...

基本信息

化学结构

分子式

C₉H₁₄ClNO₂

分子量

203.66596

精确质量

203.07130637

电荷

InChI

InChI=1S/C9H13NO2.ClH/c1-10-6-9(12)7-3-2-4-8(11)5-7;/h2-5,9-12H,6H2,1H3;1H/t9-;/m0./s1

InChIKey

OCYSGIYOVXAGKQ-FVGYRXGTSA-N

Canonic Smiles

CNC[C@@H](c1cccc(c1)O)O.Cl

Isomeric Smiles

c1(cccc(c1)[C@H](CNC)O)O.Cl

计算属性

JChem

Acid pKa

9.067801

质子受体

质子供体

LogD (pH = 5.5)

-2.5509999

LogD (pH = 7.4)

-1.3510551

Log P

-0.070160724

摩尔折射率

47.2494

极化性

18.594257

极化表面积

52.49

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

别名

L-PHENYLEPHRINE HYDROCHLORIDEL-PHENYLEPHRINE HYDROCHLORIDE USP GRADEPhenylephrine hydrochloride(R)-(-)-Phenylephrine hydrochloride(R)-(-)-3-羟基-α-(甲氨基甲基)苄醇盐酸盐(R)-(-)-1-(3-羟基苯基)-2-甲氨基乙醇盐酸盐(R)-(-)-去氧肾上腺素盐酸盐(R)-(-)-3-Hydroxy-α-(methylaminomethyl)benzyl alcohol hydrochloride(R)-(-)-1-(3-Hydroxyphenyl)-2-methylaminoethanol hydrochloridePhenylephrini hydrochloridum盐酸去氧肾上腺素Levophenylephrine HydrochlorideIsophrin Hydrochloride(R)-Phenylephrine Hydrochloride(αR)-3-Hydroxy-α-[(methylamino)methyl]benzenemethanol Hydrochloride(-)-m-Hydroxy-α-[(methylamino)methyl]benzyl Alcohol HydrochlorideLexatolM-Sympatol

IUPAC标准名

3-[(1R)-1-hydroxy-2-(methylamino)ethyl]phenol hydrochloride

IUPAC传统名

phenylephrine hydrochloride

名称和标识

数据登录号

CAS号

61-76-7

EC号

200-517-3

PubChem CID

5284443