化合物信息

ID:6449

基本信息
化学结构
MolImage
分子式
C₁₄F₂₄
分子量
624.1114768
精确质量
623.96167728
电荷
0
InChI
InChI=1S/C14F24/c15-1-2(16)4(18,10(29,30)14(37,38)12(33,34)6(2,21)22)8(25,26)7(23,24)3(1,17)9(27,28)13(35,36)11(31,32)5(1,19)20
InChIKey
QKENRHXGDUPTEM-UHFFFAOYSA-N
Canonic Smiles
FC1(F)C(F)(F)C(F)(F)C(C2(C1(F)C1(F)C(F)(F)C(F)(F)C(C(C1(F)C(C2(F)F)(F)F)(F)F)(F)F)F)(F)F
Isomeric Smiles
C12(C(C(C(C(C1(C1(C(C(C2(F)F)(F)F)(C(C(C(C1(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
质子受体
0
质子供体
0
LogD (pH = 5.5)
7.4014792
LogD (pH = 7.4)
7.4014792
Log P
7.4014792
摩尔折射率
59.382
极化性
24.985563
极化表面积
0.0
可自由旋转的化学键
0
里宾斯基五规则
false
数据来源
名称和标识
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化合物性质
分子相关蛋白质
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分子图谱
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描述信息
参考文献
生物活性
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