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| Name | 3,7-Dihydro-1,3,7-Trimethyl-1H-Purine-2,6-Dione Monohydrochloride |
|---|---|
| Synonyms | 1,3,7-Trimethylpurin-7-Ium-2,6-Quinone Chloride; 3,7-Dihydro-1,3,7-Trimethyl-1H-Purine-2,6-Dione Monohydrochloride; Caffeine Hydrochloride |
| Molecular Structure |  |
| Molecular Formula | C8H11ClN4O2 |
| Molecular Weight | 230.65 |
| CAS Registry Number | 5892-18-2 |
| EINECS | 227-570-5 |
| SMILES | C[NH+]2C1=C(N(C(N(C1=O)C)=O)C)N=C2.[Cl-] |
| InChI | 1S/C8H10N4O2.ClH/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;/h4H,1-3H3;1H |
| InChIKey | VDHPYBVMFNLZQG-UHFFFAOYSA-N |
| Boiling point | 435.3°C at 760 mmHg (Cal.) |
|---|---|
| Flash point | 217°C (Cal.) |
| Market Analysis Reports |
| List of Reports Available for 3,7-Dihydro-1,3,7-Trimethyl-1H-Purine-2,6-Dione Monohydrochloride |