
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 41078-01-7 |
| Catalog No. | 2A-0204306 |
| Chinese Name | 3-ethyl-7H-purine-2,6-dione |
| Synonyms | 3-ethyl-3,7-dihydro-purine-2,6-dione; 3-Aethyl-3,7-dihydro-purin-2,6-dion; 3-Ethylxanthine; 3-ethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Formula | C7H8N4O2 |
| Molecular Weight | 180.164 |
| Density | 1.435g/cm3 |
| PubChem ID | 480225 |
| SMILES | CCn1c(=O)[nH]c(=O)c2[nH]cnc21 |
| InChI | InChI=1S/C7H8N4O2/c1-2-11-5-4(8-3-9-5)6(12)10-7(11)13/h3H,2H2,1H3,(H,8,9)(H,10,12,13) |
| InChI Key | OTUCSVCIIQRSNG-UHFFFAOYSA-N |
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