methyl 3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoate
Chemical Structure Depiction of
methyl 3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoate
methyl 3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoate
Compound characteristics
| Compound ID: | Y507-3825 |
| Compound Name: | methyl 3-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzoate |
| Molecular Weight: | 244.29 |
| Molecular Formula: | C14 H16 N2 O2 |
| Smiles: | Cc1cc(C)n(Cc2cccc(c2)C(=O)OC)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9634 |
| logD: | 1.9634 |
| logSw: | -2.1706 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.148 |
| InChI Key: | YNUYBDGRXGCBDA-UHFFFAOYSA-N |