uspto-grants-2000_10 · 10.6084/m9.figshare.5104873.v1 · US06140294
查看IDENTITY
结构与身份
- 标准SMILES
- CCc1ccc(CO)nc1
- InChIKey
- LIRQOUKPZWQBRE-UHFFFAOYSA-N
- 分子式
- C8H11NO
- 平均分子量
- 137.18 g/mol
- 单同位素质量
- 137.08406397
COMPUTED
结构计算性质
- XLogP
- 0.8
- 极性表面积
- 33.1 Ų
- 氢键供体
- 1
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 10
- 形式电荷
- 0
- 复杂度
- 95
ALIASES
名称与别名
2-Pyridinemethanol, 5-ethyl-5-Ethyl-2-pyridinemethanolDTXSID60227615RefChem:266637DTXCID10150106(5-ethylpyridin-2-yl)methanol768-61-6MFCD08059843(5-Ethyl-2-pyridyl)methanol(5-ethyl-2-pyridinyl)methanolSCHEMBL23805172-hydroxymethyl-5-ethylpyridineSCHEMBL277791042-hydroxymethyl-5-ethyl pyridineLIRQOUKPZWQBRE-UHFFFAOYSA-NAAA76861AKOS006281652AS-43806(5-Ethylpyridin-2-yl)methanol, AldrichCPRDB-031900
REACTIONS