ASPERGILLIC ACID
6-butan-2-yl-1-hydroxy-3-(2-methylpropyl)pyrazin-2-one
| Molecular Formula | C12H20N2O2 |
|---|---|
| Molecular Weight | 224.3 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 52.9 A2 |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.15248 |
| Heavy Atoms | 16 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 490-02-8 |
|---|---|
| SMILES | CCC(C)C1=CN=C(C(=O)N1O)CC(C)C |
| InChIKey | IUZCDJYHMMWBBE-UHFFFAOYSA-N |
📖 Product Overview
ASPERGILLIC ACID (CAS: 490-02-8) is a chemical compound with molecular formula C12H20N2O2 and molecular weight 224.3 g/mol. Its IUPAC systematic name is 6-butan-2-yl-1-hydroxy-3-(2-methylpropyl)pyrazin-2-one.
IUZCDJYHMMWBBE-UHFFFAOYSA-N.
SMILES: CCC(C)C1=CN=C(C(=O)N1O)CC(C)C.
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