HCID6

1-Chloro-2,4-Dinitrobenzene

C6H3ClN2O4202.55 g/molCAS 97-00-7

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IDENTITY

结构与身份

标准SMILES: O=[N+]([O-])c1ccc(Cl)c([N+](=O)[O-])c1
InChIKey: VYZAHLCBVHPDDF-UHFFFAOYSA-N
分子式: C6H3ClN2O4
平均分子量: 202.55 g/mol
单同位素质量: 201.9781343

COMPUTED

结构计算性质

等待补全

XLogP: 2.3
极性表面积: 91.6 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 0
重原子: 13
形式电荷: 0
复杂度: 224

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 113 条

1-chloro-2,4-dinitrobenzene2,4-Dinitrochlorobenzene97-00-7DinitrochlorobenzeneDNCBCDNB4-Chloro-1,3-dinitrobenzene2,4-Dinitrophenyl chlorideBenzene, 1-chloro-2,4-dinitro-Dinitrochlorobenzol1,3-Dinitro-4-chlorobenzene2,4-Dinitro-1-chlorobenzene6-Chloro-1,3-dinitrobenzene1-Chloro-2,4-dinitrobenzol1-Cloro-2,4-dinitrobenzeneNSC-6292DTXSID6020278GE3IBT7BMNCHEBI:347181-Chloro-2,4-dinitrobenzeen

REACTIONS

参与反应

148 条

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05731405

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uspto-grants-1995_06 · 10.6084/m9.figshare.5104873.v1 · US05424405

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uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07425568B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08829204B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08829204B2

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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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