7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-carbonitrile
7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8020-7959 |
| Compound Name: | 7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 201.18 |
| Molecular Formula: | C11 H7 N O3 |
| Smiles: | CC1=C(C#N)C(=O)Oc2cc(ccc12)O |
| Stereo: | ACHIRAL |
| logP: | 1.4584 |
| logD: | 1.4292 |
| logSw: | -2.1164 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.833 |
| InChI Key: | GLGBPOSQDAZSIZ-UHFFFAOYSA-N |