methyl 5-{[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}furan-2-carboxylate
Chemical Structure Depiction of
methyl 5-{[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}furan-2-carboxylate
methyl 5-{[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}furan-2-carboxylate
Compound characteristics
| Compound ID: | 4182-0760 |
| Compound Name: | methyl 5-{[(2-hexyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl)oxy]methyl}furan-2-carboxylate |
| Molecular Weight: | 438.52 |
| Molecular Formula: | C26 H30 O6 |
| Smiles: | CCCCCCc1cc2C3CCCCC=3C(=O)Oc2cc1OCc1ccc(C(=O)OC)o1 |
| Stereo: | ACHIRAL |
| logP: | 7.1567 |
| logD: | 7.1567 |
| logSw: | -5.7079 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.41 |
| InChI Key: | ZYZOXSFQTALFOF-UHFFFAOYSA-N |