4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
Chemical Structure Depiction of
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl acetate
Compound characteristics
| Compound ID: | Y040-2171 |
| Compound Name: | 4-butyl-8-methyl-2-oxo-2H-1-benzopyran-7-yl acetate |
| Molecular Weight: | 274.31 |
| Molecular Formula: | C16 H18 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5218 |
| logD: | 3.5218 |
| logSw: | -3.7035 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.168 |
| InChI Key: | JSACDJYNCAWGCT-UHFFFAOYSA-N |