8,8-dimethyl-2-oxo-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-6,7-diyl (2E,2'E)bis(2-methylbut-2-enoate)
Chemical Structure Depiction of
8,8-dimethyl-2-oxo-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-6,7-diyl (2E,2'E)bis(2-methylbut-2-enoate)
8,8-dimethyl-2-oxo-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-6,7-diyl (2E,2'E)bis(2-methylbut-2-enoate)
Compound characteristics
| Compound ID: | N005-0002 |
| Compound Name: | 8,8-dimethyl-2-oxo-7,8-dihydro-2H,6H-benzo[1,2-b:5,4-b']dipyran-6,7-diyl (2E,2'E)bis(2-methylbut-2-enoate) |
| Molecular Weight: | 426.47 |
| Molecular Formula: | C24 H26 O7 |
| Smiles: | C\C=C(/C)C(=O)OC1C(C(C)(C)Oc2cc3c(C=CC(=O)O3)cc12)OC(C(\C)=C\C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.701 |
| logD: | 3.701 |
| logSw: | -4.0316 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.693 |
| InChI Key: | LBKPHBYDOWPFMZ-UHFFFAOYSA-N |