HCID53302113

Ethyl 5-Bromo-1-methyl-1H-pyrazole-4-carboxylate

ethyl 5-bromo-1-methylpyrazole-4-carboxylate

C7H9BrN2O2233.06 g/molCAS 105486-72-4

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)c1cnn(C)c1Br
InChIKey: OMQVPOJHVUMCGK-UHFFFAOYSA-N
分子式: C7H9BrN2O2
平均分子量: 233.06 g/mol
单同位素质量: 231.98474

COMPUTED

结构计算性质

等待补全

XLogP: 1.5
极性表面积: 44.1 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 3
重原子: 12
形式电荷: 0
复杂度: 177

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 24 条

105486-72-4ETHYL 5-BROMO-1-METHYL-1H-PYRAZOLE-4-CARBOXYLATEDTXSID70693302RefChem:595700DTXCID70644051106-442-1ETHYL 5-BROMO-1-METHYLPYRAZOLE-4-CARBOXYLATEMFCD131898315-Bromo-1-methyl-1H-pyrazole-4-carboxylic acid ethyl esterethyl 5-bromo-1-methyl-pyrazole-4-carboxylate1H-Pyrazole-4-carboxylic acid, 5-bromo-1-methyl-, ethyl esterSCHEMBL2315523OMQVPOJHVUMCGK-UHFFFAOYSA-NAKOS015899813AB69212FD10518DS-11410SY128882DB-059364CS-0007675

REACTIONS