| 货号 (SKU) | 包装规格 | 是否现货 | 价格 | 数量 |
|---|---|---|---|---|
| T173083-1g |
1g |
期货  |
|
| 英文别名 | 1260422-99-8 | tert-Butyl 2-methyl-1,4-diazepane-1-carboxylate | 1-Boc-2-methyl-1,4-diazepane | 1-BOC-2-METHYL-[1,4]DIAZEPANE | MFCD18432596 | DTXSID10696897 | AKOS022172279 | PB21465 | SB13047 | SB13048 | AS-43485 | SY100014 | 2-Methyl-homopiperazine, N1-BOC protected | CS-004841 |
|---|---|
| 规格或纯度 | 97% |
| 英文名称 | tert-butyl 2-methyl-1,4-diazepane-1-carboxylate |
| 储存温度 | 室温 |
| 运输条件 | 常规运输 |
| IUPAC Name | tert-butyl 2-methyl-1,4-diazepane-1-carboxylate |
|---|---|
| INCHI | InChI=1S/C11H22N2O2/c1-9-8-12-6-5-7-13(9)10(14)15-11(2,3)4/h9,12H,5-8H2,1-4H3 |
| InChi Key | FPUHWSHGYILARO-UHFFFAOYSA-N |
| Canonical SMILES | CC1CNCCCN1C(=O)OC(C)(C)C |
| Isomeric SMILES | CC1CNCCCN1C(=O)OC(C)(C)C |
| PubChem CID | 53414774 |
| 分子量 | 214.309 |
| 分子量 | 214.300 g/mol |
|---|---|
| XLogP3 | 1.200 |
| 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 | 2 |
| 精确质量Exact Mass | 214.168 Da |
| 单同位素质量Monoisotopic Mass | 214.168 Da |
| 拓扑极表面积Topological Polar Surface Area | 41.600 Ų |
| 重原子数Heavy Atom Count | 15 |
| 形式电荷Formal Charge | 0 |
| 复杂度Complexity | 223.000 |
| 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 | 0 |
| 未定义的原子立体中心计数Undefined Atom Stereocenter Count | 1 |
| 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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