3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2,4,6-trimethylbenzoate
Chemical Structure Depiction of
3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2,4,6-trimethylbenzoate
3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2,4,6-trimethylbenzoate
Compound characteristics
| Compound ID: | 4300-0094 |
| Compound Name: | 3-(4-methoxyphenoxy)-4-oxo-4H-1-benzopyran-7-yl 2,4,6-trimethylbenzoate |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C26 H22 O6 |
| Smiles: | Cc1cc(C)c(C(=O)Oc2ccc3C(C(=COc3c2)Oc2ccc(cc2)OC)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.5856 |
| logD: | 5.5856 |
| logSw: | -5.6129 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.492 |
| InChI Key: | CQUDOMKUFJAQQQ-UHFFFAOYSA-N |