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| IUPAC Name: | 3-ethyl-7H-purin-6-imine |
| Description: | 3-Ethyl-adenine has been identified in urine of cigarette smokers |
| Molecular Weight: | 163.18 |
| Molecular Formula: | C7H9N5 |
| Canonical SMILES: | CCN1C=NC(=N)C2=C1N=CN2 |
| InChI: | InChI=1S/C7H9N5/c1-2-12-4-11-6(8)5-7(12)10-3-9-5/h3-4,8H,2H2,1H3,(H,9,10) |
| InChI Key: | XAZTXNQITCBSCJ-UHFFFAOYSA-N |
| Melting Point: | 220-222°C |
| Solubility: | DMSO (Slightly), Methanol (Slightly) |
| Appearance: | White to Off-White Solid |
| Storage: | -20°C, Inert atmosphere |
| References: | Prevost, V., et al. Chem. Res. Tox, 9, 439 (1996). |
Catalog: BB002009
Ethylenesulfate
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Catalog: BB016397
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