2-(Methylamino)-5-sulphobenzoic acid

Base Information

• Chemical Name: 2-(Methylamino)-5-sulphobenzoic acid
• CAS No.: 89-42-9
• Molecular Formula: C8H9 N O5 S
• Molecular Weight: 231.22576
• European Community (EC) Number: 201-907-6
• UNII: 7Y75ML85VW
• DSSTox Substance ID: DTXSID60237471
• Nikkaji Number: J182.064H
• Wikidata: Q83119648
• Mol file: 89-42-9.mol

Synonyms:2-(methylamino)-5-sulfobenzoic acid;89-42-9;2-(Methylamino)-5-sulphobenzoic acid;EINECS 201-907-6;Benzoic acid, 2-(methylamino)-5-sulfo-;7Y75ML85VW;SCHEMBL9189150;DTXSID60237471;N-Methyl-5-sulfoanthranilic acid;2-(methylamino)-5-sulfobenzoesyre;2-methylamino-5-sulphobenzoic acid;Anthranilic acid, N-methyl-5-sulfo-

Chemical Property of 2-(Methylamino)-5-sulphobenzoic acid

Chemical Property:

• PSA: 112.08000
• Density: 1.603g/cm³
• LogP: 1.82700
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 231.02014356
• Heavy Atom Count: 15
• Complexity: 333

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1=C(C=C(C=C1)S(=O)(=O)O)C(=O)O