| 物质名称 | CAFFEINE BENZOATE |
|---|---|
| 异名/同义词 | 1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3,7-TRIMETHYL-, BENZOATE (1:1) 1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3,7-TRIMETHYL-, MONOBENZOATE BENZOIC ACID, COMPD. WITH 3,7-DIHYDRO-1,3,7-TRIMETHYL-1H-PURINE-2,6-DIONE (1:1) BENZOIC ACID, COMPD. WITH CAFFEINE (1:1) CAFFEINE BENZOATE CAFFEINE, MONOBENZOATE |
| CAS登记号 | 5743-17-9 |
| 物质唯一标识(Unique Ingredient Identifier) | C2154V12SE |
| 分子式 | C8H10N4O2.C7H6O2 |
| 国际化合物标识(International Chemical Identifier,InChI) | VXXKVQICUHMECR-UHFFFAOYSA-N |
| SMILES | n1(c(=O)c2n(C)cnc2n(C)c1=O)C.c1cccc(c1)C(O)=O |
| 分子结构式 |  |
| 欧洲化学品管理局注册号(ECHA) | 227-257-3 |
| 成分类型 | INGREDIENT SUBSTANCE / chemical |
| 关联数据 | |
| 扩展资源 |