4-[5-(2-bromophenoxy)pentyl]-3,5-dimethyl-1H-pyrazole--hydrogen chloride (1/1)
Chemical Structure Depiction of
4-[5-(2-bromophenoxy)pentyl]-3,5-dimethyl-1H-pyrazole--hydrogen chloride (1/1)
4-[5-(2-bromophenoxy)pentyl]-3,5-dimethyl-1H-pyrazole--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5813-2150 |
| Compound Name: | 4-[5-(2-bromophenoxy)pentyl]-3,5-dimethyl-1H-pyrazole--hydrogen chloride (1/1) |
| Molecular Weight: | 373.72 |
| Molecular Formula: | C16 H21 Br N2 O |
| Salt: | HCl |
| Smiles: | Cc1c(CCCCCOc2ccccc2[Br])c(C)[nH]n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7513 |
| logD: | 4.7508 |
| logSw: | -4.5194 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.3863 |
| InChI Key: | HVTRUEIXHHISLC-UHFFFAOYSA-N |