compound introduction
结构
CAS number:93-80-1 molecular formula:C10H9Cl3O3
结构
| Chinese alias | - | ||
| English alias | Butyricacid, 4-(2,4,5-trichlorophenoxy)- (6CI,7CI,8CI); 2,4,5-TB; 4-(2,4,5-Trichlorophenoxy)butanoic acid; 4-(2,4,5-Trichlorophenoxy)butyricacid; NSC 102787; g-(2,4,5-Trichlorophenoxy)butyric acid | ||
| CAS number | 93-80-1 | molecular formula | C10H9Cl3O3 |
| molecular weight | 283.5 | Exact mass | - |
| PSA | 46.5 | logp | 4.2 |
| CAS | 93-80-1 |
| UNII | 8JM4UCP94P |
| Wikidata | Q27270641 |
| NSC Number | NSC Number: NSC102787 |
| PubChem CID | 7162 |
| Nikkaji Number | J4.686H |
| DSSTox Substance ID | DTXSID7041334 |
| European Community (EC) Number | 202-278-0 |
| PubChem Reference Collection SID | 505438485 |
| XLogP3 | 4.2 |
| 复杂性 | 237 |
| Exact Mass | 281.961727 |
| 形式电荷 | 0 |
| 重原子计数 | 16 |
| Molecular Weight | 283.5 |
| Monoisotopic Mass | 281.961727 |
| 可旋转键计数 | 5 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 3 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 46.5 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 |
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