HCID8492

2-Chloro-4-nitroaniline

C6H5ClN2O2172.57 g/molCAS 121-87-9

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IDENTITY

结构与身份

标准SMILES: Nc1ccc([N+](=O)[O-])cc1Cl
InChIKey: LOCWBQIWHWIRGN-UHFFFAOYSA-N
分子式: C6H5ClN2O2
平均分子量: 172.57 g/mol
单同位素质量: 172.0039551

COMPUTED

结构计算性质

等待补全

XLogP: 2.1
极性表面积: 71.8 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 0
重原子: 11
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 73 条

2-Chloro-4-nitroaniline121-87-9Ocpna2-Chloro-4-nitrobenzenamineo-Chloro-p-nitroaniline4-Nitro-2-chloroaniline1-AMINO-2-CHLORO-4-NITROBENZENEBenzenamine, 2-chloro-4-nitro-Aniline, 2-chloro-4-nitro-DTXSID40219732-chloro-4-nitrophenylamineortho-Chloro-para-nitroanilineXSA3ZX337BNSC-3548DTXCID201973RefChem:429187204-502-2MFCD000076652-chloro-4-nitro-aniline2-Chloro-4-nitro-phenylamine

REACTIONS

参与反应

69 条

uspto-grants-1979_11 · 10.6084/m9.figshare.5104873.v1 · US04173646

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uspto-grants-2004_03 · 10.6084/m9.figshare.5104873.v1 · US06699975B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-1989_07 · 10.6084/m9.figshare.5104873.v1 · US04851445

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uspto-grants-2011_01 · 10.6084/m9.figshare.5104873.v1 · US07871446B2

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