CAS 19159-25-2|Trimethylsilylsucrose|({3,4-bis[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}-5-({3,4,5-tris[(trimethylsilyl)oxy]-6-{[(trimethylsilyl)oxy]methyl}oxan-2-yl}oxy)oxolan-2-yl}metho...

基本信息

化学结构

分子式

C₃₆H₈₆O₁₁Si₈

分子量

919.74544

精确质量

918.43242583

电荷

InChI

InChI=1S/C36H86O11Si8/c1-48(2,3)37-25-28-30(43-51(10,11)12)32(45-53(16,17)18)33(46-54(19,20)21)35(40-28)42-36(27-39-50(7,8)9)34(47-55(22,23)24)31(44-52(13,14)15)29(41-36)26-38-49(4,5)6/h28-35H,25-27H2,1-24H3

InChIKey

JDAONBLATRVCRV-UHFFFAOYSA-N

Canonic Smiles

C[Si](OCC1(OC2OC(CO[Si](C)(C)C)C(C(C2O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)OC(C(C1O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)(C)C

Isomeric Smiles

C[Si](C)(C)OCC1C(C(C(C(O1)OC1(C(C(C(O1)CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)CO[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C

计算属性

JChem

质子受体

质子供体

LogD (pH = 5.5)

12.2129

LogD (pH = 7.4)

12.2129

Log P

12.2129

摩尔折射率

197.7813

极化性

96.77158

极化表面积

101.53

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

别名

Trimethylsilylsucrose

IUPAC标准名

({3,4-bis[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}-5-({3,4,5-tris[(trimethylsilyl)oxy]-6-{[(trimethylsilyl)oxy]methyl}oxan-2-yl}oxy)oxolan-2-yl}methoxy)trimethylsilane

IUPAC传统名

({3,4-bis[(trimethylsilyl)oxy]-5-{[(trimethylsilyl)oxy]methyl}-5-({3,4,5-tris[(trimethylsilyl)oxy]-6-{[(trimethylsilyl)oxy]methyl}oxan-2-yl}oxy)oxolan-2-yl}methoxy)trimethylsilane

名称和标识

数据登录号

PubChem SID

PubChem CID

CAS号

MDL号

数据登录号

化合物性质