2-(2-Methylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid

Base Information

• Chemical Name: 2-(2-Methylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid
• CAS No.: 618382-85-7
• Molecular Formula: C15H12N2O2S
• Molecular Weight: 284.34
• Hs Code.: 2934999090
• European Community (EC) Number: 649-446-3
• DSSTox Substance ID: DTXSID60377785
• Wikidata: Q82167145
• Mol file: 618382-85-7.mol

Synonyms:618382-85-7;3-(Thiophen-2-yl)-1-o-tolyl-1H-pyrazole-5-carboxylic acid;2-(2-methylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid;3-(Thiophen-2-yl)-1-(o-tolyl)-1H-pyrazole-5-carboxylic acid;5-thiophen-2-yl-2-o-tolyl-2h-pyrazole-3-carboxylic acid;DTXSID60377785;AKOS022631591;5-THIOPHEN-2-YL-2-O-TOLYL-2H-PYRAZOLE-3-CARBOXYLICACID;1-(2-METHYLPHENYL)-3-(2-THIENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID

Chemical Property of 2-(2-Methylphenyl)-5-thiophen-2-ylpyrazole-3-carboxylic acid

Chemical Property:

• Vapor Pressure: 2.42E-11mmHg at 25°C
• Boiling Point: 512.8°C at 760 mmHg
• PKA: 3.23±0.36(Predicted)
• Flash Point: 264°C
• PSA: 83.36000
• Density: 1.33g/cm³
• LogP: 3.60740
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 284.06194880
• Heavy Atom Count: 20
• Complexity: 366

Purity/Quality:

99% ^*data from raw suppliers

3-(Thiophen-2-yl)-1-o-tolyl-1H-pyrazole-5-carboxylicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1N2C(=CC(=N2)C3=CC=CS3)C(=O)O