化合物信息

ID:99837

基本信息
化学结构
MolImage
分子式
C₂₄H₉F₁₈P
分子量
670.2732786
精确质量
670.01544488
电荷
0
InChI
InChI=1S/C24H9F18P/c25-19(26,27)10-1-11(20(28,29)30)5-16(4-10)43(17-6-12(21(31,32)33)2-13(7-17)22(34,35)36)18-8-14(23(37,38)39)3-15(9-18)24(40,41)42/h1-9H
InChIKey
ITJHLZVYLDBFOJ-UHFFFAOYSA-N
Canonic Smiles
FC(c1cc(cc(c1)C(F)(F)F)P(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(F)F
Isomeric Smiles
P(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)(c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F
计算属性
JChem
质子受体
0
质子供体
0
LogD (pH = 5.5)
10.4034
LogD (pH = 7.4)
10.4034
Log P
10.4034
摩尔折射率
117.4651
极化性
40.966278
极化表面积
0.0
可自由旋转的化学键
9
里宾斯基五规则
false
数据来源
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名称和标识
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数据登录号
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化合物性质
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分子相关蛋白质
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分子图谱
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描述信息
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参考文献
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生物活性
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