4-butyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
4-butyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-2155 |
| Compound Name: | 4-butyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 286.37 |
| Molecular Formula: | C18 H22 O3 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(ccc12)OCC=C(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.0263 |
| logD: | 5.0263 |
| logSw: | -4.7637 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.0634 |
| InChI Key: | ACPDCDSSQOEJEF-UHFFFAOYSA-N |