CAS 355-02-2|perfluoromethylcyclohexane|1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)cyclohexane|Perfluoro(methylcyclohexane)|Perfluoro(methylcyclohexane) 95%|(Trifluoromethyl)undecafluoroc...

基本信息

化学结构

分子式

C₇F₁₄

分子量

350.0525448

精确质量

349.97764508

电荷

InChI

InChI=1S/C7F14/c8-1(7(19,20)21)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12

InChIKey

QIROQPWSJUXOJC-UHFFFAOYSA-N

Canonic Smiles

FC1(C(F)(F)F)C(F)(F)C(F)(F)C(C(C1(F)F)(F)F)(F)F

Isomeric Smiles

C1(C(C(C(C(C1(F)F)(F)C(F)(F)F)(F)F)(F)F)(F)F)(F)F

计算属性

JChem

质子受体

质子供体

LogD (pH = 5.5)

4.642835

LogD (pH = 7.4)

4.642835

Log P

4.642835

摩尔折射率

32.9501

极化性

13.429513

极化表面积

0.0

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

perfluoromethylcyclohexane

IUPAC标准名

1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)cyclohexane

别名

Perfluoro(methylcyclohexane)Perfluoro(methylcyclohexane) 95%(Trifluoromethyl)undecafluorocyclohexane全氟甲基环己烷全氟甲基环己烷十一氟(三氟甲基)环己烷Perfluoro(methylcyclohexane)十一氟(三氟甲基)环己烷Perfluoromethylcyclohexane(Trifluoromethyl)undecafluorocyclohexane全氟(甲基环己烷)

名称和标识

数据登录号

CAS号

355-02-2

PubChem SID

2485828316096975324887169

EC号

206-573-5

MDL号

MFCD00001468

Beilstein号

1915981