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 |