3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl thiophene-2-carboxylate
Chemical Structure Depiction of
3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl thiophene-2-carboxylate
3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4986-1435 |
| Compound Name: | 3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-dibenzo[b,d]pyran-1-yl thiophene-2-carboxylate |
| Molecular Weight: | 340.4 |
| Molecular Formula: | C19 H16 O4 S |
| Smiles: | Cc1cc2c(C3CCCCC=3C(=O)O2)c(c1)OC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9721 |
| logD: | 4.9721 |
| logSw: | -4.8595 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.563 |
| InChI Key: | OGEDGQLVMMUECC-UHFFFAOYSA-N |