Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-methoxy-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-

Base Information

• Chemical Name: Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-methoxy-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-
• CAS No.: 7342-13-4
• Deprecated CAS: 62212-68-4
• Molecular Formula: C34H30N10O8S2
• Molecular Weight: 770.86
• European Community (EC) Number: 230-857-8
• UNII: O0NCT1R16F
• Mol file: 7342-13-4.mol

Synonyms:4,4-bis-(2''-methoxy-4''''-phenylamino-1'''',3'',5''-triazine-6''-ylamino)stilbene-2,2''-disulfonic acid;Belofor KB;Belofor KB, disodium salt

Chemical Property of Benzenesulfonic acid, 2,2'-(1,2-ethenediyl)bis(5-((4-methoxy-6-(phenylamino)-1,3,5-triazin-2-yl)amino)-

Chemical Property:

• Refractive Index: 1.7400 (estimate)
• PSA: 282.34000
• Density: 1.2410 (rough estimate)
• LogP: 5.56120
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 18
• Rotatable Bond Count: 14
• Exact Mass: 770.16895030
• Heavy Atom Count: 54
• Complexity: 1310

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)C=CC3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)OC)S(=O)(=O)O)S(=O)(=O)O)NC6=CC=CC=C6
• Isomeric SMILES: COC1=NC(=NC(=N1)NC2=CC(=C(C=C2)/C=C/C3=C(C=C(C=C3)NC4=NC(=NC(=N4)NC5=CC=CC=C5)OC)S(=O)(=O)O)S(=O)(=O)O)NC6=CC=CC=C6

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