HCID693342

4-Chloro-2-pyridinecarbonitrile

4-chloropyridine-2-carbonitrile

C6H3ClN2138.55 g/molCAS 19235-89-3

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IDENTITY

结构与身份

标准SMILES: N#Cc1cc(Cl)ccn1
InChIKey: DYEZRXLVZMZHQT-UHFFFAOYSA-N
分子式: C6H3ClN2
平均分子量: 138.55 g/mol
单同位素质量: 137.9984758

COMPUTED

结构计算性质

等待补全

XLogP: 1.5
极性表面积: 36.7 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 0
重原子: 9
形式电荷: 0
复杂度: 137

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 37 条

4-Chloro-2-cyanopyridine4-Chloro-2-pyridinecarbonitrileRefChem:521168606-272-219235-89-34-chloropyridine-2-carbonitrile4-Chloropicolinonitrile4-Chloro-pyridine-2-carbonitrile2-Cyano-4-chloropyridine2-PYRIDINECARBONITRILE, 4-CHLORO-MFCD060098334-Chloro-2-cyano-pyridine2-cyano-4-pyridyl chlorideSCHEMBL546523SCHEMBL4917154SCHEMBL293634234-Chloro-2-pyridine carbonitrileDTXSID60351222CL0191SBB055696

REACTIONS

参与反应

95 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07732465B2

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uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07732465B2

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uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08541588B2

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uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440922B2

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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 (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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