[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2)
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![[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2) structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/06579a2fc66e43e6a137672b6b1c2569.png "[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2)")
[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2)
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CAS No:
6104-53-6
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Formula:
C33H22N6O8S4.2Na
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Chemical Name:
[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2)
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Synonyms:
[2,6′-Bibenzothiazole]-7-sulfonic acid,2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-,sodium salt (1:2);C.I. Direct Brown 80,disodium salt;[2,6′-Bibenzothiazole]-7-sulfonic acid,2′-[4-[[2,6-dihydroxy-3-[(4-sulfophenyl)azo]phenyl]azo]phenyl]-6-methyl-,disodium salt;C.I. 20210;C.I. Direct Brown 80;Hispamin Brown TG;Thiazine Brown G;Direct Brown 80
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CAS No:
[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2) Basic Attributes
802.78684
802.002085
228-056-3
Computed Properties
Molecular Weight:802.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:8
Exact Mass:802.00208488
Monoisotopic Mass:802.00208488
Topological Polar Surface Area:303
Heavy Atom Count:53
Complexity:1480
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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[2,6′-Bibenzothiazole]-7-sulfonic acid, 2′-[4-[2-[2,6-dihydroxy-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]-6-methyl-, sodium salt (1:2)
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