3-acetyl-6-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-acetyl-6-nitro-2H-1-benzopyran-2-one
3-acetyl-6-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8006-7843 |
| Compound Name: | 3-acetyl-6-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 233.18 |
| Molecular Formula: | C11 H7 N O5 |
| Smiles: | CC(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2869 |
| logD: | 1.2869 |
| logSw: | -2.1469 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.368 |
| InChI Key: | GRICKQQNBMVHCM-UHFFFAOYSA-N |