disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate
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![disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/7db8ee9cf4d74a74866341f574a51d21.png "disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate")
disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate
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CAS No:
55698-26-5
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Formula:
C37H32N6O10S3.2Na
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Chemical Name:
disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate
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Synonyms:
[1,1′-Biphenyl]-3-sulfonic acid,4-[2-[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-3′,5-dimethyl-4′-[2-[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]diazenyl]-,sodium salt (1:2);[1,1′-Biphenyl]-3-sulfonic acid,4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulfophenyl)-1H-pyrazol-4-yl]azo]-3′,5-dimethyl-4′-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]azo]-,disodium salt
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CAS No:
disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate Basic Attributes
860.84284
860.09800
259-763-5
Computed Properties
Molecular Weight:860.8
Hydrogen Bond Acceptor Count:15
Rotatable Bond Count:9
Exact Mass:860.09809326
Monoisotopic Mass:860.09809326
Topological Polar Surface Area:265
Heavy Atom Count:58
Complexity:1780
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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disodium 4-[[4,5-dihydro-3-methyl-5-oxo-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]azo]-3',5-dimethyl-4'-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]azo][1,1'-biphenyl]-3-sulphonate
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