3-(4-bromophenyl)-4-methyl-6-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-bromophenyl)-4-methyl-6-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
3-(4-bromophenyl)-4-methyl-6-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | G856-6225 |
| Compound Name: | 3-(4-bromophenyl)-4-methyl-6-[(3-methylbut-2-en-1-yl)oxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 399.28 |
| Molecular Formula: | C21 H19 Br O3 |
| Smiles: | CC(C)=CCOc1ccc2c(c1)C(C)=C(C(=O)O2)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.3221 |
| logD: | 6.3221 |
| logSw: | -5.6252 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.3063 |
| InChI Key: | KJVZHCDIWBSDJU-UHFFFAOYSA-N |