4-butyl-7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
4-butyl-7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
4-butyl-7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-3721 |
| Compound Name: | 4-butyl-7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one |
| Molecular Weight: | 364.44 |
| Molecular Formula: | C23 H24 O4 |
| Smiles: | CCCCC1=CC(=O)Oc2cc(C)cc(c12)OCC(c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4264 |
| logD: | 5.4264 |
| logSw: | -5.4033 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.207 |
| InChI Key: | LLQRJUGHLGZYGO-UHFFFAOYSA-N |