8-methoxy-2-oxo-2H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
8-methoxy-2-oxo-2H-1-benzopyran-3-carbonitrile
8-methoxy-2-oxo-2H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 1151-0234 |
| Compound Name: | 8-methoxy-2-oxo-2H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 201.18 |
| Molecular Formula: | C11 H7 N O3 |
| Smiles: | COc1cccc2C=C(C#N)C(=O)Oc12 |
| Stereo: | ACHIRAL |
| logP: | 1.6521 |
| logD: | 1.6521 |
| logSw: | -1.9571 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 45.531 |
| InChI Key: | TZYPRPCYNHPLDY-UHFFFAOYSA-N |