6-hexyl-7-[(3-methylphenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-hexyl-7-[(3-methylphenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
6-hexyl-7-[(3-methylphenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-7250 |
| Compound Name: | 6-hexyl-7-[(3-methylphenyl)methoxy]-4-phenyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 426.56 |
| Molecular Formula: | C29 H30 O3 |
| Smiles: | CCCCCCc1cc2C(=CC(=O)Oc2cc1OCc1cccc(C)c1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 8.3541 |
| logD: | 8.3541 |
| logSw: | -5.7225 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.6884 |
| InChI Key: | XIHMHGXLSXQEFT-UHFFFAOYSA-N |