化合物信息

ID:100438

基本信息
化学结构
MolImage
分子式
C₁₈H₁₉F₂₁O₃Si
分子量
710.3936272
精确质量
710.07681362
电荷
0
InChI
InChI=1S/C18H19F21O3Si/c1-4-40-43(41-5-2,42-6-3)8-7-9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)14(29,30)15(31,32)16(33,34)17(35,36)18(37,38)39/h4-8H2,1-3H3
InChIKey
KWEUJTRPCBXYLS-UHFFFAOYSA-N
Canonic Smiles
CCO[Si](CCC(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)(OCC)OCC
Isomeric Smiles
[Si](OCC)(OCC)(OCC)CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(C(F)(F)C(C(F)(F)F)(F)F)(F)F
计算属性
JChem
质子受体
3
质子供体
0
LogD (pH = 5.5)
10.3565
LogD (pH = 7.4)
10.3565
Log P
10.3565
摩尔折射率
92.7495
极化性
37.97129
极化表面积
27.69
可自由旋转的化学键
18
里宾斯基五规则
false
数据来源
名称和标识
数据登录号
化合物性质
分子相关蛋白质
暂无数据
点击上传数据
分子图谱
暂无数据
点击上传数据
描述信息
暂无数据
点击上传数据
参考文献
生物活性
导 航