1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?)
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![1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/c95197fbdd1541cfa7be028f21c893f5.png "1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?)")
1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?)
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CAS No:
85959-12-2
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Formula:
C20H14Cl2N8O9S2.xNa
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Chemical Name:
1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?)
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Synonyms:
1H-Pyrazole-3-carboxylic acid,4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-,sodium salt (1:?);1H-Pyrazole-3-carboxylic acid,4-[[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]azo]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-,sodium salt
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CAS No:
1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?) Basic Attributes
711.35485
709.916
289-002-2
Computed Properties
Molecular Weight:711.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:5
Exact Mass:709.9160545
Monoisotopic Mass:709.9160545
Topological Polar Surface Area:279
Heavy Atom Count:44
Complexity:1250
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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1H-Pyrazole-3-carboxylic acid, 4-[2-[5-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-2-sulfophenyl]diazenyl]-4,5-dihydro-1-(2-methyl-4-sulfophenyl)-5-oxo-, sodium salt (1:?)
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