2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid
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![2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/10d854f0928a4340a8507a21fcc87ca7.png "2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid")
2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid
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CAS No:
5557-16-4
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Formula:
C22H20N4O13S4
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Chemical Name:
2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid
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Synonyms:
1,5-Naphthalenedisulfonic acid,2-[2-[4,5-dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-;1,5-Naphthalenedisulfonic acid,2-[[1-[p-[(2-hydroxyethyl)sulfonyl]phenyl]-3-methyl-5-oxo-2-pyrazolin-4-yl]azo]-,hydrogen sulfate (ester);1,5-Naphthalenedisulfonic acid,2-[[4,5-dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]azo]-;1,5-Naphthalenedisulfonic acid,2-[[1-[p-[(2-hydroxyethyl)sulfonyl]phenyl]-3-methyl-5-oxo-2-pyrazolin-4-yl]azo]-,hydrogen sulfate;2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid;101297-61-4;52683-88-2;848171-07-3
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CAS No:
2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid Basic Attributes
676.67300
676.67
226-919-9
2-[2-[4,5-Dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-1,5-naphthalenedisulfonic acid Use and Manufacturing
1,5-Naphthalenedisulfonic acid, 2-[2-[4,5-dihydro-3-methyl-5-oxo-1-[4-[[2-(sulfooxy)ethyl]sulfonyl]phenyl]-1H-pyrazol-4-yl]diazenyl]-: INACTIVE
Computed Properties
Molecular Weight:676.7
XLogP3:0.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:10
Exact Mass:675.99097140
Monoisotopic Mass:675.99097140
Topological Polar Surface Area:297
Heavy Atom Count:43
Complexity:1550
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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