4-[[4'-[[2,4-Dihydroxy-5-[(4-sulfophenyl)azo]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-

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Catalog Number
ACM94199538
Product Name
4-[[4'-[[2,4-Dihydroxy-5-[(4-sulfophenyl)azo]phenyl]azo][1,1'-biphenyl]-4-yl]azo]-4,5-dihydro-5-oxo-1-(4-sulfophenyl)-
Structure
Structure
CAS
94199-53-8
Category
Heterocyclic Organic Compound
Synonyms
EINECS 303-426-8, 4-((4-((2,4-Dihydroxy-5-((4-sulphophenyl)azo)phenyl)azo)(1,1-biphenyl)-4-yl)azo)-4,5-dihydro-5-oxo-1-(4-sulphophenyl)-1H-pyrazole-3-carboxylic acid, sodium salt, 94199-53-8
IUPAC Name
trisodium 4-[[4-[4-[(2E)-2-[4-hydroxy-6-oxo-3-[(4-sulfonatophenyl)diazenyl]cyclohexa-2,4-dien-1-ylidene]hydrazinyl]phenyl]phenyl]diazenyl]-5-oxo-1-(4-sulfonatophenyl)-4H-pyrazole-3-carboxylate
Molecular Weight
850.676850 [g/mol]
Molecular Formula
C34H21N8Na3O11S2
Canonical SMILES
C1=CC(=CC=C1C2=CC=C(C=C2)N=NC3C(=NN(C3=O)C4=CC=C(C=C4)S(=O)(=O)[O-])C(=O)[O-])NN=C5C=C(C(=CC5=O)O)N=NC6=CC=C(C=C6)S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChI Key
SDUBCYANHPAEAG-BJOITPFUSA-K
EC Number
303-426-8
Exact Mass
850.04600
H-Bond Acceptor
18
H-Bond Donor
2
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