8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate
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![8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/2cb1132b71c24fa095ffcab45792447c.png "8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate")
8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate
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CAS No:
63680-64-8
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Formula:
C17H19N3O11S
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Chemical Name:
8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate
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Synonyms:
63680-64-8;DTXSID70979951;5-Quinolinesulfonic acid, 8-hydroxy-7-((beta-hydroxy-p-nitro-alpha-oxo)phenethylamino)-, trihydrate;8-Hydroxy-7-(2-hydroxy-2-(4-nitrophenyl)acetamido)quinoline-5-sulfonic acid trihydrate;2-Hydroxy-N-(8-hydroxy-5-sulfoquinolin-7-yl)-2-(4-nitrophenyl)ethanimidic acid--water (1/3)
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CAS No:
8-hydroxy-7-[[2-hydroxy-2-(4-nitrophenyl)acetyl]amino]quinoline-5-sulfonic acid;trihydrate Basic Attributes
473.4 g/mol
473.07402960 g/mol
Computed Properties
Molecular Weight:473.4
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:4
Exact Mass:473.07402960
Monoisotopic Mass:473.07402960
Topological Polar Surface Area:194
Heavy Atom Count:32
Complexity:713
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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