CAS 345-78-8|CAS 24221-86-1|D-PSEUDOEPHEDRINE HCl|(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride|pseudoephedrine hydrochloride|(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride|d-...

基本信息

化学结构

分子式

C₁₀H₁₆ClNO

分子量

201.69314

精确质量

201.09204182

电荷

InChI

InChI=1S/C10H15NO.ClH/c1-8(11-2)10(12)9-6-4-3-5-7-9;/h3-8,10-12H,1-2H3;1H/t8-,10+;/m0./s1

InChIKey

BALXUFOVQVENIU-KXNXZCPBSA-N

Canonic Smiles

CN[C@H]([C@H](c1ccccc1)O)C.Cl

Isomeric Smiles

Cl.CN[C@@H](C)[C@@H](O)c1ccccc1

计算属性

JChem

Acid pKa

13.889531

质子受体

质子供体

LogD (pH = 5.5)

-1.8580045

LogD (pH = 7.4)

-0.7786886

Log P

1.3178347

摩尔折射率

49.6873

极化性

19.85273

极化表面积

32.26

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

D-PSEUDOEPHEDRINE HCl(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochlorided-伪麻黄碱盐酸盐(+)-伪麻黄碱盐酸盐d-Isoephedrine hydrochlorided-异麻黄碱盐酸盐(+)-ψ-麻黄碱盐酸盐(1S,2S)-2-甲氨基-1-苯丙醇盐酸盐d-Pseudoephedrine hydrochloride(+)-ψ-Ephedrine hydrochloride(1S,2S)-2-Methylamino-1-phenylpropanol hydrochloride(+)-Pseudoephedrine hydrochloride(1S,2R)-(+)-Ephedrine Hydrochlorided-Ephedrine Hydrochloride1S,2S-(+)-Pseudoephedrine HydrochlorideRhinalair(αS)-α-[(1S)-1-(Methylamino)ethyl]benzenemethanol HydrochlorideGalpseudNovafedSudafedNSC 106567Sinufed(1S,2R)-(+)-2-(Methylamino)-1-phenylpropan-1-ol Hydrochlorideα-[1-(Methylamino)ethyl]benzenemethanol Hydrochloride(+)-Pseudoephedrine HydrochlorideDecongess SROtrinol(+)-Pseudoephedrine HydrochlorideL-(+)-Pseudoephedrine Hydrochloride

IUPAC标准名

(1S,2S)-2-(methylamino)-1-phenylpropan-1-ol hydrochloride

IUPAC传统名

pseudoephedrine hydrochloride

名称和标识

数据登录号

CAS号

345-78-824221-86-1

Beilstein号

3915112

PubChem SID

2489448216208934524887972