4-butyl-8-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-8-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
4-butyl-8-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2185 |
| Compound Name: | 4-butyl-8-methyl-7-[(2-methylprop-2-en-1-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C18 H22 O3 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2C)OCC(C)=C |
| Stereo: | ACHIRAL |
| logP: | 5.0601 |
| logD: | 5.0601 |
| logSw: | -4.7717 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.9157 |
| InChI Key: | BNVQTVGONOUOIY-UHFFFAOYSA-N |