3-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde
3-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde
Compound characteristics
| Compound ID: | R052-2723 |
| Compound Name: | 3-(3,4-dimethylphenyl)-1H-pyrazole-4-carbaldehyde |
| Molecular Weight: | 200.24 |
| Molecular Formula: | C12 H12 N2 O |
| Smiles: | Cc1ccc(cc1C)c1c(C=O)c[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 2.8208 |
| logD: | 2.8207 |
| logSw: | -3.0523 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.588 |
| InChI Key: | BGDVYQOYEPSTDI-UHFFFAOYSA-N |