| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| B627567-1g |
1g |
期货  |
| |
| B627567-5g |
5g |
期货 |
|
| 别名 | (3R,6S)-1-苄氧羰基-6-甲基-哌啶-3-羧酸 |
|---|---|
| 英文别名 | (3R,6S)-1-cbz-6-Methyl-piperidine-3-carboxylic acid | MFCD31638093 | P19279 | AKOS037651853 | (3R,6S)-6-methyl-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid | (3R,6S)-1-((Benzyloxy)carbonyl)-6-methylpiperidine-3-carboxylic acid | 1227917-61-4 | CS-1 |
| 规格或纯度 | 97% |
| 英文名称 | (3R,6S)-1-benzyloxycarbonyl-6-methyl-piperidine-3-carboxylic acid |
| 运输条件 | 常规运输 |
| IUPAC Name | (3R,6S)-6-methyl-1-phenylmethoxycarbonylpiperidine-3-carboxylic acid |
|---|---|
| INCHI | InChI=1S/C15H19NO4/c1-11-7-8-13(14(17)18)9-16(11)15(19)20-10-12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3,(H,17,18)/t11-,13+/m0/s1 |
| InChi Key | WHBWAWHXIPKUMC-WCQYABFASA-N |
| Canonical SMILES | CC1CCC(CN1C(=O)OCC2=CC=CC=C2)C(=O)O |
| Isomeric SMILES | C[C@H]1CC[C@H](CN1C(=O)OCC2=CC=CC=C2)C(=O)O |
| 关联CAS | 1227917-61-4 |
| PubChem CID | 58284656 |
| 分子量 | 277.31 |
| 分子量 | 277.310 g/mol |
|---|---|
| XLogP3 | 2.100 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 4 |
| 可旋转键计数Rotatable Bond Count | 4 |
| 精确质量Exact Mass | 277.131 Da |
| 单同位素质量Monoisotopic Mass | 277.131 Da |
| 拓扑极表面积Topological Polar Surface Area | 66.800 Ų |
| 重原子数Heavy Atom Count | 20 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 352.000 |
| 同位素原子数Isotope Atom Count | 0 |
| 定义的原子立体中心计数Defined Atom Stereocenter Count | 2 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 0 |
| 定义的键立体中心计数Defined Bond Stereocenter Count | 0 |
| 未定义的键立体中心计数Undefined Bond Stereocenter Count | 0 |
| 所有立体化学键的总数The total count of all stereochemical bonds | 0 |
| 共价键合单元计数Covalently-Bonded Unit Count | 1 |
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