CAS 74256-14-7|3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl 2-methylprop-2-enoate|3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluorometh...

基本信息

化学结构

分子式

C₁₇H₉F₂₃O₂

分子量

682.2154336

精确质量

682.02352859

电荷

InChI

InChI=1S/C17H9F23O2/c1-5(2)6(41)42-4-3-7(18,19)9(21,22)11(25,26)13(29,30)15(33,34)14(31,32)12(27,28)10(23,24)8(20,16(35,36)37)17(38,39)40/h1,3-4H2,2H3

InChIKey

PVMWMBHAEVDBQR-UHFFFAOYSA-N

Canonic Smiles

CC(=C)C(=O)OCCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric Smiles

O(CCC(C(C(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(=O)C(=C)C

计算属性

JChem

质子受体

质子供体

LogD (pH = 5.5)

9.277888

LogD (pH = 7.4)

9.277888

Log P

9.277888

摩尔折射率

83.2736

极化性

32.222214

极化表面积

26.3

可自由旋转的化学键

里宾斯基五规则

false

数据来源

产品目录

学术数据

数据来源

名称和标识

IUPAC传统名

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl 2-methylprop-2-enoate

IUPAC标准名

3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-icosafluoro-11-(trifluoromethyl)dodecyl 2-methylprop-2-enoate

别名

2-(Perfluoro-9-methyldecyl)ethyl methacrylate 97%3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-二十氟-11-(三氟甲基)十二烷基甲基丙烯酸酯3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,12,12,12-Eicosafluoro-11-(trifluoromethyl)dodecyl methacrylate

名称和标识

数据登录号

CAS号

MDL号

PubChem SID

PubChem CID

EC号