compound introduction
烟酸烟酸酯是有机分子实体。
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[3-(pyridine-3-carbonyloxy)-2,2-bis(pyridine-3-carbonyloxymethyl)propyl] pyridine-3-carboxylate
CAS number：5868-05-3 molecular formula：C29H24N4O8
overview
Specs
| Chinese alias | 烟酸戊四醇酯,四烟酸季戊四醇酯 | ||
| English alias | Perycit | NICERITROL [MART.] | Pentaerythritoltetranicotinate | Niceritrolum [INN-Latin] | NICERITROL [JAN] | Niceritrolum | Q824174 | Cardiolipol | CAS-5868-05-3 | Niceritrol (JP17/INN) | Niceritrol [INN:BAN:DCF:JAN] | D01754 | MFCD00215982 | BRN 0377170 | ||
| CAS number | 5868-05-3 | molecular formula | C29H24N4O8 |
| molecular weight | 556.5 | Exact mass | ≥95% |
| PSA | 157 | logp | 2.3 |
numbering system
| CAS | 5868-05-3 |
| UNII | F54EHJ34MV |
| HMDB ID | HMDB0255580 |
| KEGG ID | D01754 |
| ChEBI ID | 31903 |
| Wikidata | Q824174 |
| ChEMBL ID | CHEMBL1697762 |
| Wikipedia | Niceritrol |
| DrugBank ID | DB13441 |
| DrugCentral | 1911 |
| PubChem CID | 4476 |
| Nikkaji Number | J3.417G |
| NCI 词表代码 | C75257 |
| DSSTox Substance ID | DTXSID1023364 |
| Metabolomics Workbench ID | 154250 |
| European Community (EC) Number | 227-519-7 |
| PubChem Reference Collection SID | 504687588 |
| International Nonproprietary Names (INN) | NICERITROL |
physicochemical properties
| XLogP3 | XLogP3-AA: 2.3 |
| 复杂性 | 745 |
| Exact Mass | 556.15941374 |
| 形式电荷 | 0 |
| 重原子计数 | 41 |
| Molecular Weight | 556.5 |
| Monoisotopic Mass | 556.15941374 |
| 可旋转键计数 | 16 |
| 氢键供体计数 | 0 |
| 氢键受体计数 | 12 |
| 共价键单元计数 | 1 |
| 同位素原子计数 | 0 |
| 拓扑极性表面积 | 157 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：橡胶和塑料制品业。
应用场景参考：适用于产品性能验证、质量检测和过程控制等应用环节，可作为检测相关材料或实验耗材使用 。
作用参考：在电池、电子、信息材料和高端制造等技术方向，常被视为可拓展的功能材料或中间材料 。
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 。
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downstream information
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MSDS
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