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2-(2-cyclopentyl-2-hydroxy-2-thiophen-2-ylacetyl)oxyethyl-diethyl-methylazanium bromide
CAS number：60-44-6 molecular formula：C18H30BrNO3S
overview
Specs
| Chinese alias | - | ||
| English alias | - | ||
| CAS number | 60-44-6 | molecular formula | C18H30BrNO3S |
| molecular weight | 420.4 | Exact mass | - |
| PSA | 74.8 | logp | - |
numbering system
| CAS | 60-44-6 |
| UNII | MA4DVZ926O |
| KEGG ID | D07081 |
| Wikidata | Q27283749 |
| ChEMBL ID | CHEMBL2105315 |
| NSC Number | NSC Number: NSC61814 |
| PubChem CID | 6066 |
| Related CAS | 22064-27-3 (Parent) |
| DSSTox Substance ID | DTXSID60875110 |
| European Community (EC) Number | 200-478-2 |
| PubChem Reference Collection SID | 516574707 |
physicochemical properties
| 复杂性 | 394 |
| Exact Mass | 419.11298 |
| 形式电荷 | 0 |
| 重原子计数 | 24 |
| Molecular Weight | 420.4 |
| Monoisotopic Mass | 419.11298 |
| 可旋转键计数 | 9 |
| 氢键供体计数 | 1 |
| 氢键受体计数 | 5 |
| 共价键单元计数 | 2 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 74.8 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 | 1 |
Safety information
No safety information yet
Production methods and uses
purpose
工业应用参考：
工业分类参考：农副食品加工业。
应用场景参考：常见于生产制造场景，可作为主料、辅料、添加剂或工艺辅助材料参与配方与加工流程 。
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：实际选型应结合产品定位、纯度要求、设备精细化程度和现场环境综合判断，不宜仅凭单一指标决定 。
Related
upstream information
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downstream information
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MSDS
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