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碘丙酮是一种有机分子实体。
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propyl 2-(3,5-diiodo-4-oxo-1-pyridinyl)acetate
CAS number：587-61-1 molecular formula：C10H11I2NO3
overview
Specs
| Chinese alias | - | ||
| English alias | Propyliodone; PROPYLIODONE(ROPYLIODONE); 3,5-Diiodo-4-oxo-1(4H)-pyridineacetic acid propyl; Brosombra; Dionosil; Propiodone; Propylix | ||
| CAS number | 587-61-1 | molecular formula | C10H11I2NO3 |
| molecular weight | 447.01 | Exact mass | - |
| PSA | 46.6 | logp | 2.4 |
numbering system
| CAS | 587-61-1 |
| UNII | 5NPJ6BPX36 |
| HMDB ID | HMDB0256841 |
| KEGG ID | D01755 |
| ChEBI ID | 32064 |
| Wikidata | Q7250472 |
| ChEMBL ID | CHEMBL1200821 |
| Wikipedia | Propyliodone |
| NSC Number | NSC Number: NSC97103 |
| DrugBank ID | DB09366 |
| DrugCentral | 2306 |
| PubChem CID | 4949 |
| Nikkaji Number | J2.072I |
| NCI 词表代码 | C66494 |
| DSSTox Substance ID | DTXSID6023527 |
| Metabolomics Workbench ID | 152359 |
| European Community (EC) Number | 209-603-5 |
| PubChem Reference Collection SID | 483927876 |
| International Nonproprietary Names (INN) | PROPYLIODONE |
physicochemical properties
| XLogP3 | XLogP3-AA: 2.4 |
| 复杂性 | 341 |
| Exact Mass | 446.88284 |
| Human Drugs | FDA批准药物 -> 活性成分 |
| 形式电荷 | 0 |
| 重原子计数 | 16 |
| Molecular Weight | 447.01 |
| Monoisotopic Mass | 446.88284 |
| 可旋转键计数 | 5 |
| 氢键供体计数 | 0 |
| 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 | 46.6 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
No safety information yet
Production methods and uses
purpose
工业应用参考：
工业分类参考：医药制造业。
应用场景参考：在环境监测、水资源分析、矿产检测、农残筛查和大气污染研究等方向具备潜在应用空间 。
作用参考：可作为基础工业材料参与合成、提纯或改性过程，为后续产品制造和工艺放大提供支撑 。
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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downstream information
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MSDS
Found 0 shareMSDS
