4-(4-carbamoylphenyl)benzoic Acid

Base Information

• Chemical Name: 4-(4-carbamoylphenyl)benzoic Acid
• CAS No.: 166386-38-5
• Molecular Formula: C₁₄H₁₁NO₃
• Molecular Weight: 241.246
• DSSTox Substance ID: DTXSID40444424
• Nikkaji Number: J883.037A
• ChEMBL ID: CHEMBL107525
• Mol file: 166386-38-5.mol

Synonyms:4-(4-carbamoylphenyl)benzoic Acid;166386-38-5;CHEMBL107525;4'-carbamoyl-[1,1'-biphenyl]-4-carboxylic acid;SCHEMBL6500925;DTXSID40444424;QHLNIHHGHTXGDF-UHFFFAOYSA-N;BDBM50060994;4'-Carbamoylbiphenyl-4-carboxylic acid;4''-Carbamoyl-biphenyl-4-carboxylic acid;4'-carbamoyl-[1,1'-biphenyl]-4-carboxylicacid;EN300-1585737;4'-(Aminocarbonyl)[1,1'-biphenyl]-4-carboxylic acid

Chemical Property of 4-(4-carbamoylphenyl)benzoic Acid

Chemical Property:

• Boiling Point: 490.0±38.0 °C(Predicted)
• PKA: 4.07±0.10(Predicted)
• PSA: 80.39000
• Density: 1.297±0.06 g/cm3(Predicted)
• LogP: 2.85100
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 241.07389321
• Heavy Atom Count: 18
• Complexity: 313

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C2=CC=C(C=C2)C(=O)O)C(=O)N