CAS 335-27-3|1,1,2,2,3,3,4,5,5,6-decafluoro-4,6-bis(trifluoromethyl)cyclohexane|Perfluoro-1,3-dimethylcyclohexane, tech.|perfluorodimethylcyclohexane|Perfluoro-1,3-dimethylcyclohexane|FlutecR PP3|Pe...

基本信息

化学结构

分子式

C₈F₁₆

分子量

400.0600512

精确质量

399.97445152

电荷

InChI

InChI=1S/C8F16/c9-1(7(19,20)21)3(11,12)2(10,8(22,23)24)5(15,16)6(17,18)4(1,13)14

InChIKey

LOQGSOTUHASIHI-UHFFFAOYSA-N

Canonic Smiles

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

Isomeric Smiles

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

计算属性

JChem

质子受体

质子供体

LogD (pH = 5.5)

5.0818143

LogD (pH = 7.4)

5.0818143

Log P

5.0818143

摩尔折射率

37.8922

极化性

15.349893

极化表面积

0.0

可自由旋转的化学键

里宾斯基五规则

false

数据来源

名称和标识

IUPAC标准名

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

别名

Perfluoro-1,3-dimethylcyclohexane, tech.Perfluoro-1,3-dimethylcyclohexaneFlutecR PP3Perfluoro(1,3-dimethylcyclohexane) 90%PERFLUORODIMETHYLCYCLOHEXANE (MIX 1,3 AND 1,4 ISOMERS)4,6-Bis(trifluoromethyl)-1,1,2,2,3,3,4,5,5,6-decafluorocyclohexaneHexadecafluoro(1,3-dimethylcyclohexane)Hexadecafluoro-1,3-dimethylcyclohexanePerfluoro-1,3-dimethylcyclohexaneDecafluoro-1,3-bis(trifluoromethyl)cyclohexane十六氟-1,3-二甲基环己烷十六氟-1,3-二甲基环己烷（顺反异构体混合物）全氟-1,3-二甲基环己烷十氟-1,3-双(三氟甲基)环己烷Hexadecafluoro-1,3-dimethylcyclohexane (cis+trans)Hexadecafluoro-1,3-dimethylcyclohexane1,1,2,2,3,3,4,5,5,6-十氟代-4,6-双(三氟代甲基)环己烷Perfluoro-1,3-dimethylcyclohexane全氟-1,3-二甲基环己烷Perfluoro(1,3-dimethylcyclohexane)全氟(1,3-二甲基环己烷)

IUPAC传统名

perfluorodimethylcyclohexane

名称和标识

数据登录号

CAS号

EC号

MDL号

Beilstein号