HCID93899

2-Bromo-4-trifluoromethylaniline

2-bromo-4-(trifluoromethyl)aniline

C7H5BrF3N240.02 g/molCAS 57946-63-1

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IDENTITY

结构与身份

标准SMILES: Nc1ccc(C(F)(F)F)cc1Br
InChIKey: QKRJIXSZTKOFTD-UHFFFAOYSA-N
分子式: C7H5BrF3N
平均分子量: 240.02 g/mol
单同位素质量: 238.95575

COMPUTED

结构计算性质

等待补全

XLogP: 2.8
极性表面积: 26 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 0
重原子: 12
形式电荷: 0
复杂度: 159

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 40 条

57946-63-12-Bromo-4-trifluoromethylanilineVJ45J9GV4UDTXSID60206667BTFMARefChem:466630DTXCID90129158261-035-72-Bromo-4-(trifluoromethyl)aniline4-Amino-3-bromobenzotrifluorideBenzenamine, 2-bromo-4-(trifluoromethyl)-MFCD000421503-BROMO-4-AMINOBENZOTRIFLUORIDE2-bromo-4-(trifluoromethyl)phenylamine2-bromo-4-trifluoromethyl-phenylamineEINECS 261-035-7SCHEMBL40549SCHEMBL294492192-bromo-4-trifluoromethyl aniline2-Bromo-4-trifluoromethylphenylamine

REACTIONS

参与反应

26 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07732463B2

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uspto-grants-2008_06 · 10.6084/m9.figshare.5104873.v1 · US07384934B2

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uspto-grants-1976_03 · 10.6084/m9.figshare.5104873.v1 · US03946025

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uspto-grants-2014_01 · 10.6084/m9.figshare.5104873.v1 · US08633186B2

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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-2015_11 · 10.6084/m9.figshare.5104873.v1 · US09181276B2

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uspto-grants-2008_04 · 10.6084/m9.figshare.5104873.v1 · US07351719B2

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