2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl thiophene-2-carboxylate
Chemical Structure Depiction of
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl thiophene-2-carboxylate
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | Y040-2237 |
| Compound Name: | 2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-3-yl thiophene-2-carboxylate |
| Molecular Weight: | 360.81 |
| Molecular Formula: | C18 H13 Cl O4 S |
| Smiles: | C1CCC2=C(C1)C(=O)Oc1cc(c(cc12)[Cl])OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0208 |
| logD: | 5.0208 |
| logSw: | -5.2535 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.563 |
| InChI Key: | VPNLQGVNVIVIQW-UHFFFAOYSA-N |