Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- CN(C(=O)OC(C)(C)C)C1CCC(O)CC1
- InChIKey
- UJHKURDWYJBHPD-UHFFFAOYSA-N
- 分子式
- C12H23NO3
- 平均分子量
- 229.32 g/mol
- 单同位素质量
- 229.1677936
COMPUTED
结构计算性质
- XLogP
- 1.8
- 极性表面积
- 49.8 Ų
- 氢键供体
- 1
- 氢键受体
- 3
- 可旋转键
- 3
- 重原子
- 16
- 形式电荷
- 0
- 复杂度
- 239
ALIASES
名称与别名
4-(N-Boc-N-methylamino)cyclohexanol1256633-24-5400899-99-2561307-54-8cis-(4-Hydroxy-cyclohexyl)-methyl-carbamic acid tert-butyl estertrans-(4-Hydroxy-cyclohexyl)-methyl-carbamic acid tert-butyl estertert-Butyl (cis-4-hydroxycyclohexyl)(methyl)carbamatetert-butyl N-(4-hydroxycyclohexyl)-N-methylcarbamatetrans-4-[Boc(methyl)amino]cyclohexanoltert-Butyl (trans-4-Hydroxycyclohexyl)(methyl)carbamateMFCD09751887MFCD23106042MFCD23106043Carbamic acid, (cis-4-hydroxycyclohexyl)methyl-, 1,1-dimethylethylesterCarbamic acid, (trans-4-hydroxycyclohexyl)methyl-, 1,1-dimethylethylesterCarbamic acid, N-(4-hydroxycyclohexyl)-N-methyl-, 1,1-dimethylethyl estertert-Butyl trans-N-(4-hydroxycyclohexyl)-N-methylcarbamate4-(N-Boc-N-methylamino)cyclohexan-1-olcis-4-(N-Boc-N-methylamino)cyclohexan-1-oltrans-4-(N-Boc-N-methylamino)cyclohexan-1-ol
REACTIONS
相关反应
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