6-chloro-3,4-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-chloro-3,4-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
6-chloro-3,4-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | Y040-1747 |
Compound Name: | 6-chloro-3,4-dimethyl-7-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one |
Molecular Weight: | 292.76 |
Molecular Formula: | C16 H17 Cl O3 |
Smiles: | CC(C)=CCOc1cc2c(cc1[Cl])C(C)=C(C)C(=O)O2 |
Stereo: | ACHIRAL |
logP: | 5.3402 |
logD: | 5.3402 |
logSw: | -5.9947 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 28.6644 |
InChI Key: | PGYFSXKREBAWML-UHFFFAOYSA-N |