4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl cyclohexanecarboxylate
Chemical Structure Depiction of
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl cyclohexanecarboxylate
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl cyclohexanecarboxylate
Compound characteristics
| Compound ID: | Y040-2170 |
| Compound Name: | 4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl cyclohexanecarboxylate |
| Molecular Weight: | 342.43 |
| Molecular Formula: | C21 H26 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3877 |
| logD: | 5.3877 |
| logSw: | -5.4376 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 40.987 |
| InChI Key: | WYZKNEOJXVWZGV-UHFFFAOYSA-N |