CAS 2043-54-1|1H,1H,2H,2H-Perfluorododecyl iodide|1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-12-iodododecane|1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-12-iodododecan...

基本信息

化学结构

分子式

C₁₂H₄F₂₁I

分子量

674.0310972

精确质量

673.90224075

电荷

InChI

InChI=1S/C12H4F21I/c13-3(14,1-2-34)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)11(29,30)12(31,32)33/h1-2H2

InChIKey

HVWXRMINOYZYCK-UHFFFAOYSA-N

Canonic Smiles

ICCC(C(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)(F)F

Isomeric Smiles

C(C(C(C(C(C(C(C(C(C(CCI)(F)F)(F)F)(F)F)(F)F)(F)F)(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)

8.982971

LogD (pH = 7.4)

8.982971

Log P

8.982971

摩尔折射率

71.4584

极化性

28.552866

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

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-12-iodododecane

IUPAC传统名

1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-henicosafluoro-12-iodododecane

别名

1H,1H,2H,2H-Perfluorododecyl iodide1H,1H,2H,2H-Perfluorododecyl iodide 97%2-(Perfluorodecyl)ethyl iodide1-Iodo-1H,1H,2H,2H-perfluorododecane1-碘-1H,1H,2H,2H-全氟十二烷1H,1H,2H,2H-Perfluoro-1-iodododecane1,1,2,2-四氢全氟碘代十二烷1H,1H,2H,2H-Perfluorododecyl iodide1-碘-1H,1H,2H,2H-全氟十二烷1H,1H,2H,2H-全氟十二烷基碘化物1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-Henicosafluoro-12-iodododecane

名称和标识

数据登录号

Beilstein号

MDL号

EC号

CAS号

PubChem SID