uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846675B2
查看IDENTITY
结构与身份
- 标准SMILES
- CC1CC(O)CCN1C(=O)OC(C)(C)C
- InChIKey
- RCXJVQLRZJXWNM-UHFFFAOYSA-N
- 分子式
- C11H21NO3
- 平均分子量
- 215.29 g/mol
- 单同位素质量
- 215.15214353
COMPUTED
结构计算性质
- XLogP
- 1.4
- 极性表面积
- 49.8 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 2
- 重原子
- 15
- 形式电荷
- 0
- 复杂度
- 234
ALIASES
名称与别名
208046-23-5tert-butyl 4-hydroxy-2-methylpiperidine-1-carboxylate4-HYDROXY-2-METHYL-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTERMFCD164970401-Boc-4-hydroxy-2-methylpiperidine1-Piperidinecarboxylic acid, 4-hydroxy-2-methyl-, 1,1-dimethylethyl ester152491-46-8(trans)-tert-butyl 4-hydroxy-2-methylpiperidine-1-carboxylatetert-butyl cis-4-hydroxy-2-methylpiperidine-1-carboxylateSCHEMBL2505132RCXJVQLRZJXWNM-UHFFFAOYSA-NCGA49142AKOS023593969PB24490PB33565PB33609SB15685SB15686SB15687SB15688
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看uspto-grants-2013_02 · 10.6084/m9.figshare.5104873.v1 · US08372837B2
查看Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D
查看uspto-grants-2012_05 · 10.6084/m9.figshare.5104873.v1 · US08183381B2
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