HCID744366

3-oxo-N-[3-(trifluoromethyl)phenyl]butanamide

C11H10F3NO2245.2 g/molCAS 785-74-0

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IDENTITY

结构与身份

标准SMILES: CC(=O)CC(=O)Nc1cccc(C(F)(F)F)c1
InChIKey: YOTPJLYOOXQHKX-UHFFFAOYSA-N
分子式: C11H10F3NO2
平均分子量: 245.2 g/mol
单同位素质量: 245.06636305

COMPUTED

结构计算性质

已同步

XLogP: 3
极性表面积: 46.2 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 3
重原子: 17
形式电荷: 0
复杂度: 302

ALIASES

名称与别名

共 25 条

785-74-03-oxo-N-[3-(trifluoromethyl)phenyl]butanamide3-Oxo-N-(3-(trifluoromethyl)phenyl)butanamideButanamide,3-oxo-N-[3-(trifluoromethyl)phenyl]-3-Oxo-N-(3-trifluoromethyl-phenyl)-butyramideMFCD00201876CBDivE_003057SCHEMBL9429509SCHEMBL302128943'-trifluoromethylacetoacetanilideDTXSID603535243'-trifluoromethyl acetoacetanilideSBB023576STK350656AKOS000115168FO88941CS-0218576EU-0066748ST45113214EN300-01414

REACTIONS