3-methoxy-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Chemical Structure Depiction of
3-methoxy-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
3-methoxy-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one
Compound characteristics
| Compound ID: | Y040-0880 |
| Compound Name: | 3-methoxy-4-methyl-8,9,10,11-tetrahydrobenzo[b]cyclohepta[d]pyran-6(7H)-one |
| Molecular Weight: | 258.32 |
| Molecular Formula: | C16 H18 O3 |
| Smiles: | Cc1c(ccc2C3CCCCCC=3C(=O)Oc12)OC |
| Stereo: | ACHIRAL |
| logP: | 4.1827 |
| logD: | 4.1827 |
| logSw: | -4.4171 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.7264 |
| InChI Key: | BSWKJDUVSQKLDA-UHFFFAOYSA-N |