3-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid

Base Information

• Chemical Name: 3-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid
• CAS No.: 879996-70-0
• Molecular Formula: C10H7BrN2O2
• Molecular Weight: 267.07900
• Hs Code.: 2933199090
• DSSTox Substance ID: DTXSID80479730
• Wikidata: Q82313909
• Mol file: 879996-70-0.mol

Synonyms:3-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid;879996-70-0;5-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid;DTXSID80479730;LH0027;MFCD07367330;AKOS005171745;AKOS022675249;AKOS025394889;BS-4863;3-(3-bromophenyl)-1H-pyrazole-4-carboxylicacid;EN300-1912945;3-(3-bromo-phenyl)-1h-pyrazole-4-carboxylic acid

Chemical Property of 3-(3-bromophenyl)-1H-pyrazole-4-carboxylic acid

Chemical Property:

• PSA: 65.98000
• LogP: 2.53740
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 265.96909
• Heavy Atom Count: 15
• Complexity: 250

Purity/Quality:

98%min ^*data from raw suppliers

3-(3-Bromophenyl)-1H-pyrazole-4-carboxylic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Br)C2=C(C=NN2)C(=O)O