Benzenesulfonic acid, 5-[[4-(aminosulfonyl)-2-nitrophenyl]amino]-2-[[4-[[4-(aminosulfonyl)-2-nitrophenyl]amino]phenyl]amino]-

Base Information

• Chemical Name: Benzenesulfonic acid, 5-[[4-(aminosulfonyl)-2-nitrophenyl]amino]-2-[[4-[[4-(aminosulfonyl)-2-nitrophenyl]amino]phenyl]amino]-
• CAS No.: 12239-00-8
• Deprecated CAS: 39280-64-3
• Molecular Formula: C24H21 N7 O11 S3
• Molecular Weight: 679.65884
• European Community (EC) Number: 235-472-9
• DSSTox Substance ID: DTXSID80868049
• Nikkaji Number: J93.921H
• Wikidata: Q82854961
• Mol file: 12239-00-8.mol

Synonyms:12239-00-8;C.I. ACID BROWN 248;EINECS 235-472-9;5-(2-nitro-4-sulfamoylanilino)-2-[4-(2-nitro-4-sulfamoylanilino)anilino]benzenesulfonic acid;Benzenesulfonic acid, 5-[[4-(aminosulfonyl)-2-nitrophenyl]amino]-2-[[4-[[4-(aminosulfonyl)-2-nitrophenyl]amino]phenyl]amino]-;5-[[4-(aminosulphonyl)-2-nitrophenyl]amino]-2-[[4-[[4-(aminosulphonyl)-2-nitrophenyl]amino]phenyl]am;Benzenesulfonic acid, 5-((4-(aminosulfonyl)-2-nitrophenyl)amino)-2-((4-((4-(aminosulfonyl)-2-nitrophenyl)amino)phenyl)amino)-;5-((4-(Aminosulphonyl)-2-nitrophenyl)amino)-2-((4-((4-(aminosulphonyl)-2-nitrophenyl)amino)phenyl)amino)benzenesulphonic acid;5-[[4-(AMINOSULPHONYL)-2-NITROPHENYL]AMINO]-2-[[4-[[4-(AMINOSULPHONYL)-2-NITROPHENYL]AMINO]PHENYL]AMINO]BENZENESULPHONIC ACID;Acid brown 248;DTXSID80868049;MLOVXTFKTATMKP-UHFFFAOYSA-N;C24H21N7O11S3;C24-H21-N7-O11-S3;Benzenesulfonic acid, 5-[[4-(aminosulfonyl)-2-nitrophenyl] amino]-2-[[4-[[4-(aminosulfonyl)-2-nitrophenyl ]amino]phenyl]amino]-;C.I.10402

Chemical Property of Benzenesulfonic acid, 5-[[4-(aminosulfonyl)-2-nitrophenyl]amino]-2-[[4-[[4-(aminosulfonyl)-2-nitrophenyl]amino]phenyl]amino]-

Chemical Property:

• PSA: 327.56000
• Density: 1.734g/cm³
• LogP: 9.18370
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 16
• Rotatable Bond Count: 9
• Exact Mass: 679.04611803
• Heavy Atom Count: 45
• Complexity: 1380

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])NC3=C(C=C(C=C3)NC4=C(C=C(C=C4)S(=O)(=O)N)[N+](=O)[O-])S(=O)(=O)O

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