6-chloro-4-oxo-4H-1-benzopyran-3-carbaldehyde
Chemical Structure Depiction of
6-chloro-4-oxo-4H-1-benzopyran-3-carbaldehyde
6-chloro-4-oxo-4H-1-benzopyran-3-carbaldehyde
Compound characteristics
| Compound ID: | IB06-3503 |
| Compound Name: | 6-chloro-4-oxo-4H-1-benzopyran-3-carbaldehyde |
| Molecular Weight: | 208.6 |
| Molecular Formula: | C10 H5 Cl O3 |
| Smiles: | C1=C(C=O)C(c2cc(ccc2O1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2 |
| logD: | 2 |
| logSw: | -3.1 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 91.7 |
| InChI Key: | LIGLNCRTMDRUAO-UHFFFAOYSA-N |