HCID11747666

Benzenebutanoic acid, alpha-bromo-, ethyl ester

ethyl 2-bromo-4-phenylbutanoate

C12H15BrO2271.15 g/molCAS 82586-61-6

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)C(Br)CCc1ccccc1
InChIKey: ZLZXSWNRZFMSSS-UHFFFAOYSA-N
分子式: C12H15BrO2
平均分子量: 271.15 g/mol
单同位素质量: 270.02554

COMPUTED

结构计算性质

已同步

XLogP: 3.6
极性表面积: 26.3 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 6
重原子: 15
形式电荷: 0
复杂度: 188

ALIASES

名称与别名

共 10 条

82586-61-6Benzenebutanoic acid, alpha-bromo-, ethyl esterRefChem:324413ethyl 2-bromo-4-phenylbutanoateethyl 2-bromo-4-phenylbutyrateSCHEMBL305973DTXSID20868664ethyl alpha-bromo-4-phenylbutanoateDA-025862-bromo-4-phenyl-butyric acid ethyl ester

REACTIONS