CAS 5223-06-3|2-(5-ethylpyridin-2-yl)ethanol|2-(5-ethylpyridin-2-yl)ethan-1-ol|2-(5-Ethyl-2-pyridinyl)-1-ethanol|2-(5-Ethylpyridin-2-yl)ethanol|5-Ethyl-2-(2-hydroxyethyl)pyridine 99%|5-Ethyl-2-(β-h...

基本信息

化学结构

分子式

C₉H₁₃NO

分子量

151.20562

精确质量

151.09971404

电荷

InChI

InChI=1S/C9H13NO/c1-2-8-3-4-9(5-6-11)10-7-8/h3-4,7,11H,2,5-6H2,1H3

InChIKey

OUJMXIPHUCDRAS-UHFFFAOYSA-N

Canonic Smiles

OCCc1ccc(cn1)CC

Isomeric Smiles

n1c(CCO)ccc(c1)CC

计算属性

JChem

Acid pKa

15.707443

质子受体

质子供体

LogD (pH = 5.5)

0.9022901

LogD (pH = 7.4)

1.2572813

Log P

1.2646983

摩尔折射率

44.5364

极化性

17.25779

极化表面积

33.12

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传统名

2-(5-ethylpyridin-2-yl)ethanol

IUPAC标准名

2-(5-ethylpyridin-2-yl)ethan-1-ol

别名

2-(5-Ethyl-2-pyridinyl)-1-ethanol2-(5-Ethylpyridin-2-yl)ethanol5-Ethyl-2-(2-hydroxyethyl)pyridine 99%5-Ethyl-2-(β-hydroxyethyl)pyridine5-Ethyl-2-pyridineethanol5-Ethyl-2-(2-hydroxyethyl)pyridine5-乙基-2-(2-羟基乙基)吡啶5-Ethyl-2-pyridineethanol5-Ethyl-2-(2-hydroxyethyl)pyridine5-Ethyl-2-pyridylethanol

名称和标识

数据登录号

CAS号

MDL号

PubChem CID

Beilstein号

EC号