1-(3-Chloro-4-fluorophenyl)-3-(thiophen-2-YL)-1H-pyrazole-5-carboxylic acid

Base Information

• Chemical Name: 1-(3-Chloro-4-fluorophenyl)-3-(thiophen-2-YL)-1H-pyrazole-5-carboxylic acid
• CAS No.: 618382-87-9
• Molecular Formula: C14H8ClFN2O2S
• Molecular Weight: 322.7
• European Community (EC) Number: 649-445-8
• DSSTox Substance ID: DTXSID501152445
• Mol file: 618382-87-9.mol

Synonyms:618382-87-9;1-(3-CHLORO-4-FLUOROPHENYL)-3-(THIOPHEN-2-YL)-1H-PYRAZOLE-5-CARBOXYLIC ACID;1-(3-CHLORO-4-FLUOROPHENYL)-3-(2-THIENYL)-1H-PYRAZOLE-5-CARBOXYLIC ACID;DTXSID501152445;AKOS024412252

Chemical Property of 1-(3-Chloro-4-fluorophenyl)-3-(thiophen-2-YL)-1H-pyrazole-5-carboxylic acid

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 321.9979045
• Heavy Atom Count: 21
• Complexity: 403

Purity/Quality:

99% ^*data from raw suppliers

1-(3-Chloro-4-fluorophenyl)-3-(thiophen-2-yl)-1H-pyrazole-5-carboxylicacid 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CSC(=C1)C2=NN(C(=C2)C(=O)O)C3=CC(=C(C=C3)F)Cl