CAS 66137-74-4|5-Iodooctafluoro-3-oxapentanesulfonyl fluoride|1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethane-1-sulfonyl fluoride|1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoetho...

基本信息

化学结构

分子式

C₄F₉IO₃S

分子量

425.9960988

精确质量

425.84691684

电荷

InChI

InChI=1S/C4F9IO3S/c5-1(6,14)2(7,8)17-3(9,10)4(11,12)18(13,15)16

InChIKey

XSLYISNQTJHKMP-UHFFFAOYSA-N

Canonic Smiles

FC(C(I)(F)F)(OC(C(S(=O)(=O)F)(F)F)(F)F)F

Isomeric Smiles

S(=O)(=O)(F)C(C(OC(C(I)(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)

3.6957

LogD (pH = 7.4)

3.6957

Log P

3.6957

摩尔折射率

47.056

极化性

19.069416

极化表面积

43.37

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标准名

1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethane-1-sulfonyl fluoride

别名

5-Iodooctafluoro-3-oxapentanesulfonyl fluoride2-[(2-Iodo-1,1,2,2-tetrafluoroethyl)oxy]-1,1,2,2-tetrafluoroethanesulphonyl fluoride5-Iodooctafluoro-3-oxapentanesulphonyl fluoride5-Iodoperfluoro-3-oxapentanesulphonyl fluoride2-(2-碘-四氟乙氧基)四氟乙基硫酰氟Tetrafluoro-2-(tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride

IUPAC传统名

1,1,2,2-tetrafluoro-2-(1,1,2,2-tetrafluoro-2-iodoethoxy)ethanesulfonyl fluoride

名称和标识

数据登录号

EC号

PubChem SID

CAS号

MDL号