Mordant Orange 29 free acid

Base Information

• Chemical Name: Mordant Orange 29 free acid
• CAS No.: 20352-64-1
• Molecular Formula: C16H13N5O7S
• Molecular Weight: 419.36872
• European Community (EC) Number: 606-530-4
• UNII: 8379NT4I81
• DSSTox Substance ID: DTXSID70892515,DTXSID20864328
• Nikkaji Number: J2.438.130G
• Wikidata: Q83128944

Synonyms:Mordant Orange 29 free acid;8379NT4I81;1-Phenol-2-sulfonic acid, 6-(3-methyl-5-oxo-1-phenyl-2-pyrazolin-4-ylazo)-4-nitro-;20352-64-1;3-(2-(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-2-hydroxy-5-nitrobenzenesulfonic acid;Benzenesulfonic acid, 3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitro-;Benzenesulfonic acid, 3-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-2-hydroxy-5-nitro-;Acid Orange 74 (free acid);SCHEMBL11216524;UNII-8379NT4I81;DTXSID20864328;DTXSID70892515;2-Hydroxy-3-(1-phenyl-3-methyl-5-hydroxy-1H-pyrazole-4-ylazo)-5-nitrobenzenesulfonic acid;2-Hydroxy-3-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)diazenyl]-5-nitrobenzene-1-sulfonic acid

Chemical Property of Mordant Orange 29 free acid

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 419.05356894
• Heavy Atom Count: 29
• Complexity: 826

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=O)N(N1)C2=CC=CC=C2)N=NC3=C(C(=CC(=C3)[N+](=O)[O-])S(=O)(=O)O)O

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