CAS 41123-44-8|2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecyl 2-methylprop-2-enoate|2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecyl 2-methylprop-2-enoate|1H,1H,11H-Per...

基本信息

化学结构

分子式

C₁₅H₈F₂₀O₂

分子量

600.190884

精确质量

600.0204939

电荷

InChI

InChI=1S/C15H8F20O2/c1-4(2)5(36)37-3-7(18,19)9(22,23)11(26,27)13(30,31)15(34,35)14(32,33)12(28,29)10(24,25)8(20,21)6(16)17/h6H,1,3H2,2H3

InChIKey

PUCOLQDJAFBFDR-UHFFFAOYSA-N

Canonic Smiles

O=C(C(=C)C)OCC(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

Isomeric Smiles

C(C(C(C(C(C(C(C(C(C(COC(=O)C(=C)C)(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

Acid pKa

19.78678

质子受体

质子供体

LogD (pH = 5.5)

8.079845

LogD (pH = 7.4)

8.079845

Log P

8.079845

摩尔折射率

72.99

极化性

28.556044

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

名称和标识

IUPAC传统名

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecyl 2-methylprop-2-enoate

别名

1H,1H,11H-Perfluoroundecyl methacrylate1H,1H,11H-Perfluoroundecyl methacrylate 95%1H,1H,11H-Eicosafluoroundecyl methacrylate1H,1H,11H-Perfluoroundecyl methacrylate1H,1H,11H-全氟十一烷基甲基丙烯酸盐Methacrylic acid 1H,1H,11H-perfluoroundecyl ester

IUPAC标准名

2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11-icosafluoroundecyl 2-methylprop-2-enoate

名称和标识

数据登录号

CAS号

MDL号

PubChem SID

PubChem CID