2-bromo-1-phenylbut-1-en-1-yl 1-benzoyl-1-ethyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
Chemical Structure Depiction of
2-bromo-1-phenylbut-1-en-1-yl 1-benzoyl-1-ethyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
2-bromo-1-phenylbut-1-en-1-yl 1-benzoyl-1-ethyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
Compound characteristics
| Compound ID: | 8016-1743 |
| Compound Name: | 2-bromo-1-phenylbut-1-en-1-yl 1-benzoyl-1-ethyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate |
| Molecular Weight: | 545.43 |
| Molecular Formula: | C30 H25 Br O5 |
| Smiles: | CCC(=C(c1ccccc1)OC(C12C(c3ccccc3OC1=O)C2(CC)C(c1ccccc1)=O)=O)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.7986 |
| logD: | 6.7956 |
| logSw: | -5.9089 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.891 |
| InChI Key: | DWAVZEFFEYECQE-UHFFFAOYSA-N |