4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 2,2-dimethylpropanoate
Chemical Structure Depiction of
4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 2,2-dimethylpropanoate
4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 2,2-dimethylpropanoate
Compound characteristics
| Compound ID: | G856-6273 |
| Compound Name: | 4-methyl-2-oxo-3-phenyl-2H-1-benzopyran-6-yl 2,2-dimethylpropanoate |
| Molecular Weight: | 336.39 |
| Molecular Formula: | C21 H20 O4 |
| Smiles: | CC1=C(C(=O)Oc2ccc(cc12)OC(C(C)(C)C)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.8252 |
| logD: | 4.8252 |
| logSw: | -4.8139 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.538 |
| InChI Key: | CSKXYRUWSBOOCU-UHFFFAOYSA-N |