HCID9212604

2,4-difluoro-N-(4-fluoro-3-nitrophenyl)benzamide

C13H7F3N2O3296.2 g/mol

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IDENTITY

结构与身份

标准SMILES: O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(F)cc1F
InChIKey: VLNMFOLSMUAMAQ-UHFFFAOYSA-N
分子式: C13H7F3N2O3
平均分子量: 296.2 g/mol
单同位素质量: 296.04087658

COMPUTED

结构计算性质

已同步

XLogP: 2.9
极性表面积: 74.9 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 2
重原子: 21
形式电荷: 0
复杂度: 405

ALIASES

名称与别名

共 5 条

2,4-difluoro-N-(4-fluoro-3-nitrophenyl)benzamideSCHEMBL1198183VLNMFOLSMUAMAQ-UHFFFAOYSA-NAKOS0085909292,4-Difluoro-N-(4-fluoro-3-nitrophenyl) benzamide

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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uspto-grants-2007_11 · 10.6084/m9.figshare.5104873.v1 · US07291632B2

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uspto-grants-2007_11 · 10.6084/m9.figshare.5104873.v1 · US07291632B2

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uspto-grants-2010_09 · 10.6084/m9.figshare.5104873.v1 · US07803813B2

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uspto-grants-2010_09 · 10.6084/m9.figshare.5104873.v1 · US07803813B2

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