HCID66691568

methyl 6-bromo-1-methyl-1H-indazole-4-carboxylate

methyl 6-bromo-1-methylindazole-4-carboxylate

C10H9BrN2O2269.09 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1cc(Br)cc2c1cnn2C
InChIKey: XMFKRLQDCZWGTQ-UHFFFAOYSA-N
分子式: C10H9BrN2O2
平均分子量: 269.09 g/mol
单同位素质量: 267.98474

COMPUTED

结构计算性质

已同步

XLogP: 2.1
极性表面积: 44.1 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 2
重原子: 15
形式电荷: 0
复杂度: 262

ALIASES

名称与别名

共 16 条

methyl 6-bromo-1-methyl-1H-indazole-4-carboxylate1245465-67-1methyl6-bromo-1-methyl-1H-indazole-4-carboxylateMFCD27993386methyl 6-bromo-1-methylindazole-4-carboxylateSCHEMBL456891XMFKRLQDCZWGTQ-UHFFFAOYSA-N1h-indazole-4-carboxylic acid,6-bromo-1-methyl-,methyl esterSB12526DA-46797PS-15459SY321141CS-0184727E88206methyl 6-bromo-1-methyl-indazole-4-carboxylateF625629

REACTIONS

参与反应

3 条

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08524751B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09326987B2

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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