7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl cyclohexanecarboxylate
Chemical Structure Depiction of
7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl cyclohexanecarboxylate
7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | Y040-1313 |
| Compound Name: | 7-methyl-2-oxo-4-propyl-2H-1-benzopyran-5-yl cyclohexanecarboxylate |
| Molecular Weight: | 328.41 |
| Molecular Formula: | C20 H24 O4 |
| Smiles: | CCCC1=CC(=O)Oc2cc(C)cc(c12)OC(C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0724 |
| logD: | 5.0724 |
| logSw: | -4.8796 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.302 |
| InChI Key: | MITYODQCDBUXKI-UHFFFAOYSA-N |