methyl 4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoate
Chemical Structure Depiction of
methyl 4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoate
methyl 4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoate
Compound characteristics
| Compound ID: | Y501-6434 |
| Compound Name: | methyl 4-[(4-bromo-1H-pyrazol-1-yl)methyl]benzoate |
| Molecular Weight: | 295.13 |
| Molecular Formula: | C12 H11 Br N2 O2 |
| Smiles: | COC(c1ccc(Cn2cc(cn2)[Br])cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7278 |
| logD: | 2.7278 |
| logSw: | -2.7136 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.918 |
| InChI Key: | AYUZXMFLDXNSSF-UHFFFAOYSA-N |