Hydrogen 4-5-4-chloro-6-(4-sulphonatophenyl)amino-1,3,5-triazin-2-ylamino-2-sulphonatophenylazo-4,5-dihydro-5-ox o-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate (sodium salt)

Base Information

• Chemical Name: Hydrogen 4-5-4-chloro-6-(4-sulphonatophenyl)amino-1,3,5-triazin-2-ylamino-2-sulphonatophenylazo-4,5-dihydro-5-ox o-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate (sodium salt)
• CAS No.: 70865-25-7
• Molecular Formula: C25H18 Cl N9 O12 S3 . 3 Na
• Molecular Weight: 834.05701
• European Community (EC) Number: 274-952-2
• Mol file: 70865-25-7.mol

Synonyms:70865-25-7;Hydrogen 4-5-4-chloro-6-(4-sulphonatophenyl)amino-1,3,5-triazin-2-ylamino-2-sulphonatophenylazo-4,5-dihydro-5-ox o-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate (sodium salt);EINECS 274-952-2;4-((5-((4-Chloro-6-((4-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-2-sulfophenyl)azo)-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-1H-pyrazole-3-carboxylic acid, trisodium salt;TRISODIUM HYDROGEN 4-[[5-[[4-CHLORO-6-[(4-SULPHONATOPHENYL)AMINO]-1,3,5-TRIAZIN-2-YL]AMINO]-2-SULPHONATOPHENYL]AZO]-4,5-DIHYDRO-5-OXO-1-(4-SULPHONATOPHENYL)-1H-PYRAZOLE-3-CARBOXYLATE;C25H18ClN9O12S3.3Na;C25-H18-Cl-N9-O12-S3.3Na;W-111434;Trisodium hydrogen 4-[[5-[[4-chloro-6-[(4-sulphonatophenyl)amino]-1,3,5-triazin-2-yl]amino]-2-sulphonatophenyl]azo]-4,5-dihydro-5-ox o-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate

Chemical Property of Hydrogen 4-5-4-chloro-6-(4-sulphonatophenyl)amino-1,3,5-triazin-2-ylamino-2-sulphonatophenylazo-4,5-dihydro-5-ox o-1-(4-sulphonatophenyl)-1H-pyrazole-3-carboxylate (sodium salt)

Chemical Property:

• PSA: 357.39000
• LogP: 2.91000
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 20
• Rotatable Bond Count: 8
• Exact Mass: 832.9383910
• Heavy Atom Count: 53
• Complexity: 1610

Purity/Quality:

99% ^*data from raw suppliers

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)NC3=CC(=C(C=C3)S(=O)(=O)[O-])N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)[O-])C(=O)O)S(=O)(=O)[O-].[Na+].[Na+].[Na+]

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