5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid
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![5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/48a086024e4e4c408e41e8c01d026f12.png "5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid")
5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid
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CAS No:
117-04-4
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Formula:
C28H22N2O8S2
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Chemical Name:
5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid
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Synonyms:
anthraquinone violet;anthraquinone violet disodium salt;Anthraquinone Violet;C.I. Acid Violet 34;NSC297168;NSC-297168;C.I. 61710;SCHEMBL9173751;CHEMBL1093229;ZINC4261884;5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid;117-04-4;NCI60_002488;5-methyl-2-[[5-(4-methyl-2-sulfo-anilino)-9,10-dioxo-1-anthryl]amino]benzenesulfonic acid;2,2'-(9,10-Dihydro-9,10-dioxo-1,5-anthracenediyl)-diimino)bis-(5-methyl-benzenesulfonic acid;Benzenesulfonic acid, 2,2'-[(9,10-dihydro-9,10-dioxo-1,5-anthracenediyl)bis(imino)]bis[5-methyl-, disodium salt
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CAS No:
5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid Basic Attributes
578.6 g/mol
578.08175801 g/mol
5-methyl-2-[[5-(4-methyl-2-sulfoanilino)-9,10-dioxoanthracen-1-yl]amino]benzenesulfonic acid Use and Manufacturing
EPA Safer Chemical Functional Use Classes -> Colorants|Safer Chemical Classes -> Green half-circle - The chemical is expected to be of low concern
Computed Properties
Molecular Weight:578.6
XLogP3:5.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:578.08175801
Monoisotopic Mass:578.08175801
Topological Polar Surface Area:184
Heavy Atom Count:40
Complexity:1090
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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