5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid
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![5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/558c7860c03d4757a7bac943c65fab54.png "5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid")
5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid
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CAS No:
94088-50-3
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Formula:
C29H25ClN6O8S
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Chemical Name:
5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid
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Synonyms:
Benzoic acid,5-[2-[4-[[[[4-[2-(4-chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxy-;Benzoic acid,5-[[4-[[[[4-[(4-chloro-3-sulfophenyl)azo]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]azo]-2-hydroxy-;5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid
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CAS No:
5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid Basic Attributes
653.0622
653.06
302-051-7
Computed Properties
Molecular Weight:653.1
XLogP3:5.8
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:10
Exact Mass:652.1143106
Monoisotopic Mass:652.1143106
Topological Polar Surface Area:220
Heavy Atom Count:45
Complexity:1160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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5-[2-[4-[[[[4-[2-(4-Chloro-3-sulfophenyl)diazenyl]-2-ethoxy-5-methylphenyl]amino]carbonyl]amino]phenyl]diazenyl]-2-hydroxybenzoic acid
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