2-[3,4-bis(acetyloxy)phenyl]-5-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3,7-diyl diacetate
Chemical Structure Depiction of
2-[3,4-bis(acetyloxy)phenyl]-5-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3,7-diyl diacetate
2-[3,4-bis(acetyloxy)phenyl]-5-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3,7-diyl diacetate
Compound characteristics
| Compound ID: | 8015-0042 |
| Compound Name: | 2-[3,4-bis(acetyloxy)phenyl]-5-hydroxy-4-oxo-3,4-dihydro-2H-1-benzopyran-3,7-diyl diacetate |
| Molecular Weight: | 472.4 |
| Molecular Formula: | C23 H20 O11 |
| Smiles: | CC(=O)OC1C(c2ccc(c(c2)OC(C)=O)OC(C)=O)Oc2cc(cc(c2C1=O)O)OC(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.637 |
| logD: | 1.5299 |
| logSw: | -2.0275 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 119.842 |
| InChI Key: | JYNJWKIFSPJVHZ-UHFFFAOYSA-N |