uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06359138B1
查看![4-[(4-Fluorophenyl)methyl]piperidin-4-ol 分子结构式](/api/mol/10488624/svg/360x280.svg)
IDENTITY
结构与身份
- 标准SMILES
- OC1(Cc2ccc(F)cc2)CCNCC1
- InChIKey
- XNOZKVAOXOLUBS-UHFFFAOYSA-N
- 分子式
- C12H16FNO
- 平均分子量
- 209.26 g/mol
- 单同位素质量
- 209.1215923
COMPUTED
结构计算性质
- XLogP
- 1.5
- 极性表面积
- 32.3 Ų
- 氢键供体
- 2
- 氢键受体
- 3
- 可旋转键
- 2
- 重原子
- 15
- 形式电荷
- 0
- 复杂度
- 196
ALIASES
名称与别名
4-[(4-fluorophenyl)methyl]piperidin-4-ol193355-56-54-(4-fluorobenzyl)piperidin-4-olSCHEMBL1574254XNOZKVAOXOLUBS-UHFFFAOYSA-N4-(4-fluor-benzyl)-piperidin-4-ol4-(4-Fluoro-benzyl)-piperidin-4-olAKOS0120826834-(4-Fluorobenzyl)-4-hydroxypiperidineEN300-152234
REACTIONS
参与反应
Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
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