HCID67852

4-Bromo-3-(trifluoromethyl)aniline

C7H5BrF3N240.02 g/molCAS 393-36-2

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IDENTITY

结构与身份

标准SMILES: Nc1ccc(Br)c(C(F)(F)F)c1
InChIKey: YGNISOAUPSJDJE-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 49 条

4-Bromo-3-(trifluoromethyl)aniline393-36-24-Bromo-alpha,alpha,alpha-trifluoro-m-toluidineNSC-88332Z3SMJ2YC3EDTXSID50192540RefChem:1070400DTXCID90115031206-885-15-Amino-2-bromobenzotrifluoride4-bromo-3-trifluoromethylaniline4-Bromo-3-trifluoromethyl-phenylamineMFCD000078273-trifluoromethyl-4-bromoanilineBenzenamine, 4-bromo-3-(trifluoromethyl)-4-Amino-1-bromo-2-(trifluoromethyl)benzene4-bromo-3-(trifluoromethyl)benzenamine4-bromo-3-(trifluoromethyl)phenylamineEN300-20854NSC88332

REACTIONS

参与反应

51 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07091224B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08829199B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08841330B2

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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 (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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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2009_05 · 10.6084/m9.figshare.5104873.v1 · US07528255B2

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