4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl acetate
Chemical Structure Depiction of
4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl acetate
4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl acetate
Compound characteristics
| Compound ID: | Y043-8043 |
| Compound Name: | 4-butyl-7-methyl-2-oxo-2H-1-benzopyran-5-yl acetate |
| Molecular Weight: | 274.31 |
| Molecular Formula: | C16 H18 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(C)cc(c12)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6867 |
| logD: | 3.6867 |
| logSw: | -4.015 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.483 |
| InChI Key: | MHILHNKKHZJZIB-UHFFFAOYSA-N |