3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid
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![3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/11ce5ff908b144eaa1cfb8add2d0fc02.png "3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid")
3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid
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CAS No:
24041-30-3
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Formula:
C16H13N5O7S
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Chemical Name:
3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid
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Synonyms:
Benzenesulfonic acid,3-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitro-;Benzenesulfonic acid,4-hydroxy-3-[(3-methyl-5-oxo-1-phenyl-2-pyrazolin-4-yl)azo]-5-nitro-;Benzenesulfonic acid,3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-5-nitro-;1-Phenol-4-sulfonic acid,2-(3-methyl-5-oxo-1-phenyl-2-pyrazolin-4-ylazo)-6-nitro-;3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid;122891-62-7;1335093-32-7
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CAS No:
3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid Basic Attributes
419.36872
419.37
245-997-5
Computed Properties
Molecular Weight:419.4
XLogP3:2.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:4
Exact Mass:419.05356894
Monoisotopic Mass:419.05356894
Topological Polar Surface Area:186
Heavy Atom Count:29
Complexity:813
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-[2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-4-hydroxy-5-nitrobenzenesulfonic acid
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