InChIKey | GGWHJTJHSJIICG-UHFFFAOYSA-N |
---|---|
Inchi | 1S/C10H15S.3C4H9.Sn/c1-2-3-4-5-6-10-7-8-11-9-10;3*1-3-4-2;/h7,9H,2-6H2,1H3;3*1,3-4H2,2H3; |
SMILES | [Sn](C1=C([H])C(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])=C([H])S1)(C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])(C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H] |
LogP | 8.15210 |
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PSA | 28.24000 |
溶解度 | Insuluble (1.9E-6 g/L) (25 ºC), |
精确分子量 | 458.20300 |
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氢键供体数量 | 0 |
氢键受体数量 | 1 |
可旋转化学键数量 | 15 |
重原子数量 | 24 |
复杂度 | 270 |
拓扑分子极性表面积 | 28.2 |