3-[(4-nitrophenyl)methoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-[(4-nitrophenyl)methoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-[(4-nitrophenyl)methoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-7118 |
| Compound Name: | 3-[(4-nitrophenyl)methoxy]-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 365.38 |
| Molecular Formula: | C21 H19 N O5 |
| Smiles: | C1CCC2=C(CC1)c1ccc(cc1OC2=O)OCc1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0749 |
| logD: | 5.0749 |
| logSw: | -5.0139 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.021 |
| InChI Key: | UFOWMAKMYBZWQK-UHFFFAOYSA-N |