HCID18625655

3-(4-Fluorophenyl)-3-oxo-2-(4-pyridinyl)propanenitrile

3-(4-fluorophenyl)-3-oxo-2-pyridin-4-ylpropanenitrile

C14H9FN2O240.23 g/mol

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IDENTITY

结构与身份

标准SMILES: N#CC(C(=O)c1ccc(F)cc1)c1ccncc1
InChIKey: CLZJQEOIICYYMR-UHFFFAOYSA-N
分子式: C14H9FN2O
平均分子量: 240.23 g/mol
单同位素质量: 240.06989108

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 53.8 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 3
重原子: 18
形式电荷: 0
复杂度: 335

ALIASES

名称与别名

共 13 条

148671-42-53-(4-Fluorophenyl)-3-oxo-2-(4-pyridinyl)propanenitrile3-(4-Fluorophenyl)-3-oxo-2-(pyridin-4-yl)propanenitrile3-(4-fluorophenyl)-3-oxo-2-pyridin-4-ylpropanenitrileMFCD18071009CLZJQEOIICYYMR-UHFFFAOYSA-NSCHEMBL6176444AC4360AKOS015903885SY011587DB-0637713-(4-fluorophenyl)-3-oxo-2-(4-pyridyl)propionitrile3-(4-Fluorophenyl)-3-oxo-2-(4-pyridinyl)propanenitrile, 148671-42-5, 3-(4-Fluorophenyl)-3-oxo-2-(pyridin-4-yl)propanenitrile, SCHEMBL6176444, CLZJQEOIICYYMR-UHFFFAOYSA-N, MolPort-020-394-556, AKOS015903885, AK-85960, SY011587, DB-063771, TC-307214, K-4725, I14-17732

REACTIONS