化工网/ CAS号查询/ (3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid | 1932189-29-1

(3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid | 1932189-29-1

(3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid结构式图片|1932189-29-1结构式图片
中文名称:(3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid
英文名称:cis-6-Methyl-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester
CAS No.:1932189-29-1 分子式:C12H21NO4 分子量:243.2994
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:(3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid结构式
国内供应商 1 家
名称和标识符
Inchi 1S/C12H21NO4/c1-8-5-6-9(10(14)15)7-13(8)11(16)17-12(2,3)4/h8-9H,5-7H2,1-4H3,(H,14,15)/t8-,9+/m0/s1
InChIKey TZCMQIKRCZLVQN-DTWKUNHWSA-N
SMILES O(C(C([H])([H])[H])(C([H])([H])[H])C([H])([H])[H])C(N1C([H])([H])[C@]([H])(C(=O)O[H])C([H])([H])C([H])([H])[C@]1([H])C([H])([H])[H])=O
别名信息
- 中文别名 -
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- 英文别名 -
cis-6-Methyl-piperidine-1,3-dicarboxylic acid 1-tert-butyl ester cis-1-(tert-Butoxycarbonyl)-6-methylpiperidine-3-carboxylic acid (3R,6S)-1-Boc-6-methyl-piperidine-3-carboxylic acid P21109 (3R,6S)-1-Boc-6-methylpiperidine-3-carboxylic acid (3R,6S)-1-[(t-Butoxy)carbonyl]-6-methylpiperidine-3-carboxylic acid (3R,6S)-1-[(tert-butoxy)carbonyl]-6-methylpiperidine-3-carboxylic acid (3R,6S)-1-(TERT-BUTOXY
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物化性质
 计算特性
氢键供体数量 1
氢键受体数量 4
重原子数量 17
可旋转化学键数量 3
复杂度 308
疏水参数计算参考值(XlogP) 1.6
拓扑分子极性表面积 66.8
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