CAS 307-37-9|1H,1H-Perfluorodecan-1-ol 98%|2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecan-1-ol|1H,1H-Perfluoro-1-decanol|2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecan-1-...

基本信息

化学结构

分子式

C₁₀H₃F₁₉O

分子量

500.0998808

精确质量

499.9880509

电荷

InChI

InChI=1S/C10H3F19O/c11-2(12,1-30)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h30H,1H2

InChIKey

NIRPXSQCRWXHNZ-UHFFFAOYSA-N

Canonic Smiles

OCC(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric Smiles

FC(C(C(C(C(C(C(C(C(CO)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

计算属性

JChem

Acid pKa

12.621079

质子受体

质子供体

LogD (pH = 5.5)

6.041661

LogD (pH = 7.4)

6.0416584

Log P

6.041661

摩尔折射率

51.0554

极化性

20.33138

极化表面积

20.23

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

别名

1H,1H-Perfluorodecan-1-ol 98%1H,1H-Perfluoro-1-decanol2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Nonadecafluoro-1-decanol1H,1H-全氟-1-十醇2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Nonadecafluoro-1-decanol1H,1H-全氟-1-正癸醇1H,1H-Perfluoro-1-decanol

IUPAC传统名

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecan-1-ol

IUPAC标准名

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-nonadecafluorodecan-1-ol

名称和标识

数据登录号

CAS号

307-37-9

MDL号

MFCD00153234

EC号

000-000-0