HCID54889725

Methyl 2-(3-fluorophenyl)-2-(phenylamino)acetate

methyl 2-anilino-2-(3-fluorophenyl)acetate

C15H14FNO2259.27 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)C(Nc1ccccc1)c1cccc(F)c1
InChIKey: DWCUDNWJYBOUOE-UHFFFAOYSA-N
分子式: C15H14FNO2
平均分子量: 259.27 g/mol
单同位素质量: 259.10085685

COMPUTED

结构计算性质

已同步

XLogP: 3.6
极性表面积: 38.3 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 5
重原子: 19
形式电荷: 0
复杂度: 292

ALIASES

名称与别名

共 5 条

SCHEMBL1695890DWCUDNWJYBOUOE-UHFFFAOYSA-NAKOS005797039methyl 2-(3-fluorophenyl)-2-(phenylamino)acetate(3-fluoro-phenyl)-phenylamino-acetic acid methyl ester

REACTIONS

参与反应

8 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08835682B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08835682B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2013_10 · 10.6084/m9.figshare.5104873.v1 · US08563577B2

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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08455646B2

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uspto-grants-2013_06 · 10.6084/m9.figshare.5104873.v1 · US08455646B2

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