4-methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-2-one
Chemical Structure Depiction of
4-methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-2-one
4-methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0177 |
| Compound Name: | 4-methyl-3-pentyl-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g][1]benzopyran-2-one |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C21 H24 O3 |
| Smiles: | CCCCCC1=C(C)c2cc3c4CCCCc4oc3cc2OC1=O |
| Stereo: | ACHIRAL |
| logP: | 6.1846 |
| logD: | 6.1846 |
| logSw: | -5.3882 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.2756 |
| InChI Key: | CMCMSBATLBHKBV-UHFFFAOYSA-N |