compound introduction
6-甲基巯基嘌呤是一种在6位被甲硫基取代的9H-嘌呤的硫代嘌呤。
All
Chemical Reagents
Biomedicine
Organic raw materials
Inorganic chemical industry
intermediate
Agricultural chemicals
Auxiliaries and catalysts
Fragrances and Flavors
Dyes and Pigments
Daily chemical industry
6-methylsulfanyl-7H-purine
CAS number：50-66-8 molecular formula：C6H6N4S
overview
Specs
| Chinese alias | - | ||
| English alias | 6-(Methylthio)-9H-purine | a thiopurine S-methylether | Purine, 6-methylthio- | BIDD:GT0117 | 6-(methylsulfanyl)-9H-purine | 6-Methylsulfanyl-9H-purine | BRD-K43675242-001-01-9 | 1H-Purine, 6-(methylthio)- | NCGC00081884-02 | FT-0671906 | HMS1526D02 | AB0 | ||
| CAS number | 50-66-8 | molecular formula | C6H6N4S |
| molecular weight | 166.21 | Exact mass | ≥97% |
| PSA | 79.8 | logp | 1.1 |
numbering system
| CAS | 50-66-8 |
| UNII | 6V404DV25O |
| HMDB ID | HMDB0060412 |
| KEGG ID | C16614 |
| ChEBI ID | 28279 |
| Wikidata | Q27103606 |
| ChEMBL ID | CHEMBL1178 |
| NSC Number | NSC Number: NSC20105 |
| AIDS 编号 | 021132 |
| PharmGKB ID | PA166160612 |
| PubChem CID | 5778 |
| Nikkaji Number | J79.423F |
| DSSTox Substance ID | DTXSID50901654 |
| Metabolomics Workbench ID | 51654 |
| European Community (EC) Number | 200-057-3 |
| PubChem Reference Collection SID | 516559955 |
physicochemical properties
| XLogP3 | 1.1 |
| 复杂性 | 143 |
| Exact Mass | 166.03131738 |
| 化学类别 | 硫嘌呤 |
| 形式电荷 | 0 |
| 解离常数 | iupacpka |
| 重原子计数 | 11 |
| Molecular Weight | 166.21 |
| Monoisotopic Mass | 166.03131738 |
| 可旋转键计数 | 1 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 4 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 79.8 Ų |
| Collision Cross Section | 128 Ų [M-H]- |
| 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
No safety information yet
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：适用于实验室研发、教学科研和技术验证场景，常用于新产品开发、方法建立和样品评估 。
作用参考：在科研材料体系中具备较强的组合应用潜力，价值往往取决于具体配方、纯度等级和工艺设计 。
选型提示：面向研发或检测用途时，建议同步评估品牌一致性、批次稳定性和后续技术支持能力 。
Related
upstream information
No upstream information yet
downstream information
No downstream information yet
MSDS
Found 0 shareMSDS
