methyl 3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylate
Chemical Structure Depiction of
methyl 3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylate
methyl 3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylate
Compound characteristics
| Compound ID: | 8014-4668 |
| Compound Name: | methyl 3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylate |
| Molecular Weight: | 220.22 |
| Molecular Formula: | C12 H12 O4 |
| Smiles: | CC1(Cc2ccccc2C(=O)O1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1533 |
| logD: | 2.1533 |
| logSw: | -2.6266 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.534 |
| InChI Key: | WAFWIJMZCNUWSJ-LBPRGKRZSA-N |