2-Acetamido-6-(phenylthio)benzoic acid

Base Information

• Chemical Name: 2-Acetamido-6-(phenylthio)benzoic acid
• CAS No.: 84455-38-9
• Molecular Formula: C15H13 N O3 S
• Molecular Weight: 287.33362
• European Community (EC) Number: 282-900-5
• UNII: VZ2CB55VQE
• DSSTox Substance ID: DTXSID00233432
• Nikkaji Number: J297.715J
• Wikidata: Q83114948
• Mol file: 84455-38-9.mol

Synonyms:2-Acetamido-6-(phenylthio)benzoic acid;84455-38-9;VZ2CB55VQE;EINECS 282-900-5;UNII-VZ2CB55VQE;DTXSID00233432;2-(Acetylamino)-6-(phenylthio)benzoic acid;BENZOIC ACID, 2-(ACETYLAMINO)-6-(PHENYLTHIO)-

Chemical Property of 2-Acetamido-6-(phenylthio)benzoic acid

Chemical Property:

• Vapor Pressure: 2.97E-11mmHg at 25°C
• Boiling Point: 510.7°C at 760 mmHg
• Flash Point: 262.7°C
• PSA: 95.19000
• Density: 1.35g/cm³
• LogP: 4.14390
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 287.06161445
• Heavy Atom Count: 20
• Complexity: 355

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=C(C(=CC=C1)SC2=CC=CC=C2)C(=O)O