HCID2776554

1-methyl-1H-Imidazole-5-carbonyl chloride

3-methylimidazole-4-carbonyl chloride

C5H5ClN2O144.56 g/mol

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IDENTITY

结构与身份

标准SMILES: Cn1cncc1C(=O)Cl
InChIKey: OSRNDBCXJHFFLC-UHFFFAOYSA-N
分子式: C5H5ClN2O
平均分子量: 144.56 g/mol
单同位素质量: 144.0090405

COMPUTED

结构计算性质

已同步

XLogP: 0.9
极性表面积: 34.9 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 1
重原子: 9
形式电荷: 0
复杂度: 128

ALIASES

名称与别名

共 10 条

1-methyl-1H-Imidazole-5-carbonyl chloride41716-12-5SCHEMBL1074568OSRNDBCXJHFFLC-UHFFFAOYSA-NAKOS0159179641-methyl-1h-imidazole-5-carbonylchloride3-methyl-3H-imidazole-4-carbonyl chlorideDB-070213CS-0432602EN300-245849

REACTIONS

参与反应

9 条

uspto-grants-2009_07 · 10.6084/m9.figshare.5104873.v1 · US07566725B2

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uspto-grants-2014_10 · 10.6084/m9.figshare.5104873.v1 · US08871753B2

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uspto-grants-2006_12 · 10.6084/m9.figshare.5104873.v1 · US07144876B2

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uspto-grants-2006_12 · 10.6084/m9.figshare.5104873.v1 · US07148353B2

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Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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uspto-grants-2010_10 · 10.6084/m9.figshare.5104873.v1 · US07812022B2

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uspto-grants-2010_05 · 10.6084/m9.figshare.5104873.v1 · US07723324B2

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uspto-grants-2008_01 · 10.6084/m9.figshare.5104873.v1 · US07317029B2

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