2-[[1-[[[4'-[2-[(4-acetamido-2-carboxyphenyl)azo]acetoacetamido]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[(4-sulphoanilino)carbonyl]amino]benzoic acid, sodium salt
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2-[[1-[[[4'-[2-[(4-acetamido-2-carboxyphenyl)azo]acetoacetamido]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[(4-sulphoanilino)carbonyl]amino]benzoic acid, sodium salt
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CAS No:
97337-85-4
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Formula:
C45H41N9O13S.xNa
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Chemical Name:
2-[[1-[[[4'-[2-[(4-acetamido-2-carboxyphenyl)azo]acetoacetamido]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[(4-sulphoanilino)carbonyl]amino]benzoic acid, sodium salt
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Synonyms:
Benzoic acid,2-[[1-[[[4′-[[2-[[4-(acetylamino)-2-carboxyphenyl]azo]-1,3-dioxobutyl]amino]-3,3′-dimethyl[1,1′-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[[(4-sulfophenyl)amino]carbonyl]amino]-,sodium salt
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CAS No:
2-[[1-[[[4'-[2-[(4-acetamido-2-carboxyphenyl)azo]acetoacetamido]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[(4-sulphoanilino)carbonyl]amino]benzoic acid, sodium salt Basic Attributes
1013.9 g/mol
1013.20028632 g/mol
306-579-9
2-[[1-[[[4'-[2-[(4-acetamido-2-carboxyphenyl)azo]acetoacetamido]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]azo]-5-[[(4-sulphoanilino)carbonyl]amino]benzoic acid, sodium salt Use and Manufacturing
Benzoic acid, 2-[2-[1-[[[4'-[[2-[2-[4-(acetylamino)-2-carboxyphenyl]diazenyl]-1,3-dioxobutyl]amino]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]amino]carbonyl]-2-oxopropyl]diazenyl]-5-[[[(4-sulfophenyl)amino]carbonyl]amino]-, sodium salt (1:3): INACTIVE
Computed Properties
Molecular Weight:1013.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:17
Rotatable Bond Count:14
Exact Mass:1013.20028632
Monoisotopic Mass:1013.20028632
Topological Polar Surface Area:358
Heavy Atom Count:71
Complexity:2020
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:4
Compound Is Canonicalized:Yes
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