3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid
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![3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/4da91487519c4911887979c21a403915.png "3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid")
3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid
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CAS No:
50335-05-2
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Formula:
C20H16N4O8S2
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Chemical Name:
3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid
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Synonyms:
Acid Red 186 free acid;UNII-M0FT3OUY0D;M0FT3OUY0D;50335-05-2;(E)-3-hydroxy-4-((5-hydroxy-3-methyl-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)naphthalene-1-sulfonic acid;3-Hydroxy-4-((1-(3-sulfophenyl)-3-methyl-5-hydroxy-1H-pyrazole-4-yl)azo)-1-naphthalenesulfonic acid;3-Hydroxy-4-[[1-(3-sulfophenyl)-3-methyl-5-hydroxy-1H-pyrazole-4-yl]azo]-1-naphthalenesulfonic acid;J2.886.590B;ZINC25558261;ZINC100048466;ZINC256006430;1-Naphthalenesulfonic acid, 3-hydroxy-4-(2-(5-hydroxy-3-methyl-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)-;1-Naphthalenesulfonic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl)azo)-3-hydroxy-;1-Naphthalenesulfonic acid, 4-(2-(4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)-3-hydroxy-;3-Hydroxy-4-((5-hydroxy-3-methyl-1-(3-sulfophenyl)-1H-pyrazol-4-yl)diazenyl)-1-naphthalenesulfonic acid;Q27283303;2-hydroxy-1-[3-methyl-5-oxo-1-(3-sulfophenyl)-4-pyrazolylazo)-naphthalene-4-sulfonic acid
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CAS No:
3-hydroxy-4-[[5-methyl-3-oxo-2-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]naphthalene-1-sulfonic acid Basic Attributes
504.5 g/mol
504.04095583 g/mol
M0FT3OUY0D
Computed Properties
Molecular Weight:504.5
XLogP3:2.2
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:504.04095583
Monoisotopic Mass:504.04095583
Topological Polar Surface Area:203
Heavy Atom Count:34
Complexity:1080
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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