uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08530665B2
查看IDENTITY
结构与身份
- 标准SMILES
- C[C@H](O)c1c(Cl)cncc1Cl
- InChIKey
- KCPDCYCCMCEYQN-BYPYZUCNSA-N
- 分子式
- C7H7Cl2NO
- 平均分子量
- 192.04 g/mol
- 单同位素质量
- 190.9904692
COMPUTED
结构计算性质
- XLogP
- 1.6
- 极性表面积
- 33.1 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 1
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 124
ALIASES
名称与别名
(S)-1-(3,5-Dichloropyridin-4-yl)ethanol1370347-50-4MFCD22665797(1S)-1-(3,5-DICHLOROPYRIDIN-4-YL)ETHANOL(S)-1-(3,5-dichloropyridin-4-yl)ethan-1-ol(1S)-1-(3,5-Dichloropyridin-4-yl)ethan-1-ol4-Pyridinemethanol, 3,5-dichloro-alpha-methyl-, (alphaS)-(1S)-1-(3,5-Dichloro-4-pyridyl)ethanolSCHEMBL891636DTXSID50735855KCPDCYCCMCEYQN-BYPYZUCNSA-NCS-B0628AKOS016008189DS-4272SY116163F52522EN300-1966063F2345844-Pyridinemethanol, 3,5-dichloro-|A-methyl-, (|AS)-
REACTIONS
参与反应
uspto-grants-2012_09 · 10.6084/m9.figshare.5104873.v1 · US08268869B2
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