uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05723620
查看IDENTITY
结构与身份
- 标准SMILES
- CCOC(=O)Cc1cccc(Br)c1
- InChIKey
- CAERSDJFKGMKLY-UHFFFAOYSA-N
- 分子式
- C10H11BrO2
- 平均分子量
- 243.1 g/mol
- 单同位素质量
- 241.99424
COMPUTED
结构计算性质
- XLogP
- 3.1
- 极性表面积
- 26.3 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 4
- 重原子
- 13
- 形式电荷
- 0
- 复杂度
- 170
ALIASES
名称与别名
14062-30-7RefChem:1084850Ethyl 3-(bromophenyl)acetateEthyl 2-(3-bromophenyl)acetateEthyl 3-BromophenylacetateBenzeneacetic acid, 3-bromo-, ethyl esterMFCD09953130ethyl (3-bromophenyl)acetateethyl [3-bromophenyl]acetateEthyl2-(3-Bromophenyl)acetate(3-bromo-phenyl)-acetic acid ethyl esterethyl(3-bromophenyl)acetateEthyl (3-bromophenyI)acetateSCHEMBL788672ethyl (3-bromo-phenyl)acetateDTXSID40466949CAERSDJFKGMKLY-UHFFFAOYSA-NAB3725AKOS011268643AC-7170
REACTIONS
相关反应
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