compound introduction
溴化戊酸酯是一种烷基苯。
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diethyl-methyl-[2-(3-methyl-2-phenylpentanoyl)oxyethyl]azanium bromide
Dangerous GoodsCAS number：90-22-2 molecular formula：C19H32BrNO2
overview
Specs
| Chinese alias | N,N-二乙基-N-甲基-2-[(3-甲基-1-氧-2-苯戊基)氧代]溴乙铵 | N-[2-(2-甲基-1-苯基丁基羰基氧代)乙基]二乙基溴化甲铵 | ||
| English alias | AS-14890 | MLS006010085 | N,N-diethyl-N-methyl-2-(3-methyl-2-phenylpentanoyloxy)ethanaminium bromide | diethyl(methyl){2-[(3-methyl-2-phenylpentanoyl)oxy]ethyl}azanium bromide | N,N-Diethyl-N-methyl-2-[(3-methyl-1-oxo-2-phenylpentyl)oxy]ethanaminium bromi | ||
| CAS number | 90-22-2 | molecular formula | C19H32BrNO2 |
| molecular weight | 386.4 | Exact mass | ≥95% |
| PSA | 26.3 | logp | 4.4 |
numbering system
| CAS | 90-22-2 |
| UNII | 6XFR940M2A |
| KEGG ID | D01538 |
| ChEBI ID | 32288 |
| ChEMBL ID | CHEMBL2107687 |
| PubChem CID | 7010 |
| Pharos Ligand ID | ZMF3WFHQ7CDT |
| DSSTox Substance ID | DTXSID5049027 |
| European Community (EC) Number | 201-977-8 |
| PubChem Reference Collection SID | 505897519 |
physicochemical properties
| 复杂性 | 319 |
| Exact Mass | 385.16164 |
| 形式电荷 | 0 |
| 重原子计数 | 23 |
| Molecular Weight | 386.4 |
| Monoisotopic Mass | 385.16164 |
| 可旋转键计数 | 10 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 3 |
| 共价键单元计数 | 2 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 26.3 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 | 2 |
Safety information
危害类别和分类：
急性毒性 4 (100%)
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：适合对材料精细度、设备条件和应用环境要求较高的场景，通常需要结合工艺目标做进一步筛选 。
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：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 。
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