HCID21997680

3-Carbomethoxy-7-chloro-4-hydroxyquinoline-2-carbonyl chloride

methyl 2-carbonochloridoyl-7-chloro-4-oxo-1H-quinoline-3-carboxylate

C12H7Cl2NO4300.09 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1c(C(=O)Cl)[nH]c2cc(Cl)ccc2c1=O
InChIKey: LYUVEFJSRUXCKH-UHFFFAOYSA-N
分子式: C12H7Cl2NO4
平均分子量: 300.09 g/mol
单同位素质量: 298.9752131

COMPUTED

结构计算性质

已同步

XLogP: 3
极性表面积: 72.5 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 3
重原子: 19
形式电荷: 0
复杂度: 474

ALIASES

名称与别名

共 9 条

SCHEMBL6230583SCHEMBL6231653LYUVEFJSRUXCKH-UHFFFAOYSA-Nmethyl 7-chloro-2-(chlorocarbonyl)-4-oxo-1,4-dihydroquinoline-3-carboxylate179543-90-9DB-3083833-carbomethoxy-7-chloro-4-hydroxyquinoline-2-carbonyl chloride7-Chloro-3-methoxycarbonyl-4-oxo-1,4-dihydroquinoline-2-carbonyl chloride7-Chloro-2-chlorocarbonyl-4-oxo-1,4-dihydroquinoline-3-carboxylic Acid Methyl Ester

REACTIONS

参与反应

2 条

uspto-grants-1998_04 · 10.6084/m9.figshare.5104873.v1 · US05744471

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uspto-grants-2001_05 · 10.6084/m9.figshare.5104873.v1 · US06232313B1

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