| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| E175966-1g |
1g |
期货  |
|
| 英文别名 | DTXSID201129649 | (1R,5S)-tert-butyl 3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate | A876965 | AKOS025396212 | EN300-7095548 | AKOS025396634 | (3-exo)-tert-Butyl 3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate | (3-endo)-tert-butyl 3 |
|---|---|
| 规格或纯度 | 97% |
| 英文名称 | exo-8-boc-8-azabicyclo[3.2.1]octane-3-methanol |
| 储存温度 | 室温 |
| 运输条件 | 常规运输 |
| IUPAC Name | tert-butyl (1R,5S)-3-(hydroxymethyl)-8-azabicyclo[3.2.1]octane-8-carboxylate |
|---|---|
| INCHI | InChI=1S/C13H23NO3/c1-13(2,3)17-12(16)14-10-4-5-11(14)7-9(6-10)8-15/h9-11,15H,4-8H2,1-3H3/t9?,10-,11+ |
| InChi Key | WPHYDBXMMSEFTR-FGWVZKOKSA-N |
| Canonical SMILES | CC(C)(C)OC(=O)N1C2CCC1CC(C2)CO |
| Isomeric SMILES | CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1CC(C2)CO |
| 分子量 | 241.331 |
| Reaxy-Rn | 14339078 |
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14339078&ln= |
| 分子量 | 241.330 g/mol |
|---|---|
| XLogP3 | 1.800 |
| 氢键供体数Hydrogen Bond Donor Count | 1 |
| 氢键受体数Hydrogen Bond Acceptor Count | 3 |
| 可旋转键计数Rotatable Bond Count | 3 |
| 精确质量Exact Mass | 241.168 Da |
| 单同位素质量Monoisotopic Mass | 241.168 Da |
| 拓扑极表面积Topological Polar Surface Area | 49.800 Ų |
| 重原子数Heavy Atom Count | 17 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 284.000 |
| 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 |
| Reaxy-Rn | 14339078 |
|---|---|
| Reaxys-RN link address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14339078&ln= |
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