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ethyl 2-amino-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate
Dangerous GoodsCAS number：24237-54-5 molecular formula：C17H20N2O2S
overview
Specs
| Chinese alias | - | ||
| English alias | 2-Amino-6-benzyl-4,5,6,7-tetrahydrothieno(2,3-c)pyridine-3-carboxylic acid ethyl ester | EINECS 246-102-0 | ethyl 2-amino-6-benzyl-4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylate | TINORIDINE [MI] | DTXSID9023677 | Ethyl 2-amino-6-benzyl-4,5,6,7-tetrahydr | ||
| CAS number | 24237-54-5 | molecular formula | C17H20N2O2S |
| molecular weight | 316.4 | Exact mass | ≥95% |
| PSA | 83.8 | logp | 3.4 |
numbering system
| CAS | 24237-54-5 |
| UNII | C9Z9ICZ7YR |
| KEGG ID | D08602 |
| ChEBI ID | 135353 |
| Wikidata | Q27275368 |
| ChEMBL ID | CHEMBL592943 |
| NSC Number | NSC Number: NSC158555 |
| DrugBank ID | DB13001 |
| DrugCentral | 2672 |
| PubChem CID | 5480 |
| Related CAS | 25913-34-2 (单盐酸盐) |
| Nikkaji Number | J16.395C |
| NCI 词表代码 | C76821 |
| DSSTox Substance ID | DTXSID9023677 |
| Metabolomics Workbench ID | 153881 |
| European Community (EC) Number | 246-102-0 |
| PubChem Reference Collection SID | 500833493 |
| International Nonproprietary Names (INN) | TINORIDINE |
physicochemical properties
| XLogP3 | XLogP3-AA: 3.4 |
| 复杂性 | 387 |
| Exact Mass | 316.12454906 |
| 形式电荷 | 0 |
| 重原子计数 | 22 |
| Molecular Weight | 316.4 |
| Monoisotopic Mass | 316.12454906 |
| 可旋转键计数 | 5 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 5 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 83.8 Ų |
| 定义键立体中心计数 | 0 |
| 定义原子立体中心计数 | 0 |
| 未定义键立体中心计数 | 0 |
| 未定义原子手性中心计数 | 0 |
Safety information
危害类别和分类：
STOT SE 3 (100%)
Production methods and uses
purpose
工业应用参考：
工业分类参考：化学纤维制造业。
应用场景参考：可延伸到医疗、生物医药、科研院所及第三方检测等专业场景，但具体适用范围仍依赖技术条件 。
作用参考：可用于改善产品性能、稳定性或使用体验，在配方优化和质量提升中具备辅助价值 。
选型提示：采购时应优先考虑适配性、可追溯性和持续供货能力，避免只按价格高低判断材料优劣 。
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