3-Acetoxyxanthine
(2,6-dioxo-7H-purin-3-yl) acetate
Also Known As: 3-Acetoxyxanthine|Xanthine, 3-acetoxy-|3-Hydroxyxanthine acetate|Xanthine, 3-hydroxy-, acetate|Xanthine,3-hydroxy-,acetate|(2,6-dioxo-7H-purin-3-yl) acetate|2,6-Dioxo-1H-purin-3(2H,6H,9H)-yl acetate|1H-Purine-2,6-dione, 3-(acetyloxy)-3,7-dihydro-|3-(Acetyloxy-3,7-dihydro)-1H-purine-2,6-dione|2,6-dioxo-1H-purin-3(2H,6H,7H)-yl acetate|2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-3-yl acetate|2,6-Dioxo-1,2,6,7-tetrahydro-3H-purin-3-yl acetate|2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-3-yl acetate|Acetic acid 2,3,6,7-tetrahydro-2,6-dioxo-1H-purin-3-yl ester|Acetic acid,1,2,6,9-tetrahydro-2,6-dioxo-3H-purin-3-yl ester|ACETIC ACID, 1,2,6,9-TETRAHYDRO-2,6-DIOXO-3H-PURIN-3-YL ESTER
| Molecular Formula | C7H6N4O4 |
|---|---|
| Molecular Weight | 210.03891 g/mol |
| LogP | -1.61 |
| Topological Polar Surface Area | 109.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.03891 |
| Heavy Atoms | 15 |
| Complexity | 634.2 |
Chemical Identifiers
| CAS Number | 22052-01-3 |
|---|---|
| SMILES | CC(=O)ON1C2=C(C(=O)NC1=O)NC=N2 |
Product Overview
3-Acetoxyxanthine (CAS 22052-01-3), with molecular formula C7H6N4O4 and molecular weight 210.03891 g/mol. IUPAC: (2,6-dioxo-7H-purin-3-yl) acetate.
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