2-Acetamido-5-benzoylbenzoic acid

Base Information

• Chemical Name: 2-Acetamido-5-benzoylbenzoic acid
• CAS No.: 31684-38-5
• Molecular Formula: C16H13NO4
• Molecular Weight: 283.28
• DSSTox Substance ID: DTXSID00702815
• Nikkaji Number: J88.736F
• Wikidata: Q82634818
• Mol file: 31684-38-5.mol

Synonyms:31684-38-5;DTXSID00702815;2-acetamido-5-benzoylbenzoic acid;2-(Acetylamino)-5-benzoylbenzoic acid

Chemical Property of 2-Acetamido-5-benzoylbenzoic acid

Chemical Property:

• Boiling Point: 559.8±45.0 °C(Predicted)
• PKA: 3.15±0.10(Predicted)
• PSA: 86.96000
• Density: 1.328±0.06 g/cm3(Predicted)
• LogP: 3.22370
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 283.08445790
• Heavy Atom Count: 21
• Complexity: 415

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2)C(=O)O