3,4,7-trimethyl-5-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3,4,7-trimethyl-5-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
3,4,7-trimethyl-5-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7626 |
| Compound Name: | 3,4,7-trimethyl-5-[(4-nitrophenyl)methoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C19 H17 N O5 |
| Smiles: | CC1=C(C)c2c(cc(C)cc2OC1=O)OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6813 |
| logD: | 4.6813 |
| logSw: | -4.9313 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.856 |
| InChI Key: | ANFBYOOZWHGHIY-UHFFFAOYSA-N |