5-((4-Chloro-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulphophenyl)azo)naphthalene-2,7-disulphonic acid

Base Information

• Chemical Name: 5-((4-Chloro-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulphophenyl)azo)naphthalene-2,7-disulphonic acid
• CAS No.: 29128-95-8
• Molecular Formula: C25H18 Cl N7 O10 S3
• Molecular Weight: 708.0993
• European Community (EC) Number: 249-461-1
• DSSTox Substance ID: DTXSID201103582
• Nikkaji Number: J250.774I
• Mol file: 29128-95-8.mol

Synonyms:29128-95-8;EINECS 249-461-1;5-((4-Chloro-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulphophenyl)azo)naphthalene-2,7-disulphonic acid;C25H18ClN7O10S3;C25-H18-Cl-N7-O10-S3;2,7-Naphthalenedisulfonic acid, 5-((4-chloro-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulfophenyl)azo)-;5-[[4-chloro-6-(phenylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[(2-sulphophenyl)azo]naphthalene-2,7-disulphonic acid;Procion Red H-3B;SCHEMBL14529440;DTXSID201103582;5-[[4-Chloro-6-(phenylamino)-1,3,5-triazin-2-yl]amino]-4-hydroxy-3-[2-(2-sulfophenyl)diazenyl]-2,7-naphthalenedisulfonic acid

Chemical Property of 5-((4-Chloro-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((2-sulphophenyl)azo)naphthalene-2,7-disulphonic acid

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.84g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 9
• Exact Mass: 706.9965810
• Heavy Atom Count: 46
• Complexity: 1400

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC2=NC(=NC(=N2)Cl)NC3=C4C(=CC(=C3)S(=O)(=O)O)C=C(C(=C4O)N=NC5=CC=CC=C5S(=O)(=O)O)S(=O)(=O)O