3-acetyl-2-methyl-1-benzofuran-5,6-dicarbonitrile
Chemical Structure Depiction of
3-acetyl-2-methyl-1-benzofuran-5,6-dicarbonitrile
3-acetyl-2-methyl-1-benzofuran-5,6-dicarbonitrile
Compound characteristics
| Compound ID: | 8020-2226 |
| Compound Name: | 3-acetyl-2-methyl-1-benzofuran-5,6-dicarbonitrile |
| Molecular Weight: | 224.22 |
| Molecular Formula: | C13 H8 N2 O2 |
| Smiles: | CC(c1c2cc(C#N)c(C#N)cc2oc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.099 |
| logD: | 2.099 |
| logSw: | -2.3379 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.125 |
| InChI Key: | UCHKJRCRMABNHF-UHFFFAOYSA-N |