1H-Pyrazole-3-carboxylic acid, 1-(5-(((3,6-dichloro-4-pyridazinyl)carbonyl)amino)-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-4-((2-sulfophenyl)azo)-

Base Information

• Chemical Name: 1H-Pyrazole-3-carboxylic acid, 1-(5-(((3,6-dichloro-4-pyridazinyl)carbonyl)amino)-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-4-((2-sulfophenyl)azo)-
• CAS No.: 68399-87-1
• Molecular Formula: C22H15Cl2N7O10S2
• Molecular Weight: 672.4314
• European Community (EC) Number: 269-994-3
• DSSTox Substance ID: DTXSID60887359
• Nikkaji Number: J349.395D
• Mol file: 68399-87-1.mol

Synonyms:68399-87-1;EINECS 269-994-3;1H-Pyrazole-3-carboxylic acid, 1-(5-(((3,6-dichloro-4-pyridazinyl)carbonyl)amino)-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-4-((2-sulfophenyl)azo)-;1-[5-[[(3,6-dichloropyridazin-4-yl)carbonyl]amino]-2-methyl-3-sulphophenyl]-4,5-dihydro-5-oxo-4-[(2-sulphophenyl)azo]-1H-pyrazole-3-carboxylic acid;1H-Pyrazole-3-carboxylic acid, 1-(5-(((3,6-dichloro-4-pyridazinyl)carbonyl)amino)-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-4-(2-(2-sulfophenyl)diazenyl)-;1H-Pyrazole-3-carboxylic acid, 1-[5-[[(3,6-dichloro-4-pyridazinyl)carbonyl]amino]-2-methyl-3-sulfophenyl]-4,5-dihydro-5-oxo-4-[(2-sulfophenyl)azo]-;1-(5-(((3,6-Dichloropyridazin-4-yl)carbonyl)amino)-2-methyl-3-sulphophenyl)-4,5-dihydro-5-oxo-4-((2-sulphophenyl)azo)-1H-pyrazole-3-carboxylic acid;1H-Pyrazole-3-carboxylic acid, 1-[5-[[(3,6-dichloro-4-pyridazinyl)carbonyl]amino]-2-methyl-3-sulfophenyl]-4,5-dihydro-5-oxo-4-[2-(2-sulfophenyl)diazenyl]-;C22H15Cl2N7O10S2;DTXSID60887359;C22-H15-Cl2-N7-O10-S2;1-[2-Methyl-3-sulfo-5-(3,6-dichloro-4-pyridazinylcarbonylamino)phenyl]-4-(2-sulfophenylazo)-4,5-dihydro-5-oxo-1H-pyrazole-3-carboxylic acid

Chemical Property of 1H-Pyrazole-3-carboxylic acid, 1-(5-(((3,6-dichloro-4-pyridazinyl)carbonyl)amino)-2-methyl-3-sulfophenyl)-4,5-dihydro-5-oxo-4-((2-sulfophenyl)azo)-

Chemical Property:

• Density: 1.9g/cm³
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 15
• Rotatable Bond Count: 8
• Exact Mass: 670.9698874
• Heavy Atom Count: 43
• Complexity: 1390

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1S(=O)(=O)O)NC(=O)C2=CC(=NN=C2Cl)Cl)N3C(=O)C(C(=N3)C(=O)O)N=NC4=CC=CC=C4S(=O)(=O)O