| 中文名称: |
可可碱 |
| 中文别名: |
咖啡碱; 柯柯豆碱; 3,7-二氢-3,7-二甲基-1H-嘌呤-2,6-二酮 |
| 英文名称: |
Theobromine |
| 英文别名: |
1H-purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-; 201-494-2; 3,7-Dimethyl-3,7-dihydro-1H-purine-2,6-dione; 3,7-Diméthyl-3,7-dihydro-1H-purine-2,6-dione; 3,7-Dimethyl-xanthine; 5-26-13-00553 (Beilstein Handbook Reference); 83-67-0; Teobromin |
| CAS号: |
83-67-0 |
| EINECS号: |
201-494-2 |
| 分子式: |
C7H10N4O2 |
| 分子量: |
182.1799 |
| InChI: |
InChI=1/C7H10N4O2/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2/h3,7,13H,1-2H3,(H,9,12) |
| 分子结构: |
|
| 熔点: |
290-295℃ |
| 水溶性: |
slightly soluble, <0.1 g/100 mL at 18℃ |