4-methylphenyl 1-(4-bromobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
Chemical Structure Depiction of
4-methylphenyl 1-(4-bromobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
4-methylphenyl 1-(4-bromobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate
Compound characteristics
| Compound ID: | 8017-3179 |
| Compound Name: | 4-methylphenyl 1-(4-bromobenzoyl)-1-methyl-2-oxo-1,7b-dihydrocyclopropa[c][1]benzopyran-1a(2H)-carboxylate |
| Molecular Weight: | 491.34 |
| Molecular Formula: | C26 H19 Br O5 |
| Smiles: | Cc1ccc(cc1)OC(C12C(c3ccccc3OC1=O)C2(C)C(c1ccc(cc1)[Br])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.3199 |
| logD: | 6.3176 |
| logSw: | -5.8309 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.257 |
| InChI Key: | YNTDZWIQRRWQNG-UHFFFAOYSA-N |