3-[(5-Hydroxy-7-sulfonaphthalen-2-yl)amino]benzoic acid

Base Information

• Chemical Name: 3-[(5-Hydroxy-7-sulfonaphthalen-2-yl)amino]benzoic acid
• CAS No.: 5855-83-4
• Molecular Formula: C17H13NO6S
• Molecular Weight: 359.35322
• DSSTox Substance ID: DTXSID50572904
• Nikkaji Number: J8.299F
• Wikidata: Q82461416
• Mol file: 5855-83-4.mol

Synonyms:5855-83-4;3-[(5-Hydroxy-7-sulfonaphthalen-2-yl)amino]benzoic acid;3-(5-HYDROXY-7-SULFONAPHTHALEN-2-YLAMINO)BENZOIC ACID;3-((5-Hydroxy-7-sulfonaphthalen-2-yl)amino)benzoic acid;SCHEMBL8338202;DTXSID50572904

Chemical Property of 3-[(5-Hydroxy-7-sulfonaphthalen-2-yl)amino]benzoic acid

Chemical Property:

• PSA: 132.31000
• LogP: 4.38770
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 359.04635831
• Heavy Atom Count: 25
• Complexity: 588

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(=C1)NC2=CC3=CC(=CC(=C3C=C2)O)S(=O)(=O)O)C(=O)O