methyl 1-(4-bromobenzoyl)-1-ethyl-2-oxo-1,9c-dihydrocyclopropa[d]naphtho[2,1-b]pyran-1a(2H)-carboxylate
Chemical Structure Depiction of
methyl 1-(4-bromobenzoyl)-1-ethyl-2-oxo-1,9c-dihydrocyclopropa[d]naphtho[2,1-b]pyran-1a(2H)-carboxylate
methyl 1-(4-bromobenzoyl)-1-ethyl-2-oxo-1,9c-dihydrocyclopropa[d]naphtho[2,1-b]pyran-1a(2H)-carboxylate
Compound characteristics
| Compound ID: | 8013-5466 |
| Compound Name: | methyl 1-(4-bromobenzoyl)-1-ethyl-2-oxo-1,9c-dihydrocyclopropa[d]naphtho[2,1-b]pyran-1a(2H)-carboxylate |
| Molecular Weight: | 479.33 |
| Molecular Formula: | C25 H19 Br O5 |
| Smiles: | CCC1(C2c3c(ccc4ccccc34)OC(C12C(=O)OC)=O)C(c1ccc(cc1)[Br])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9377 |
| logD: | 5.8942 |
| logSw: | -6.8436 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 55.781 |
| InChI Key: | ZXPTXUOWQDMNMS-UHFFFAOYSA-N |