2-Hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid structure

2-Hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid

2-hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid

CAS: 6420-03-7
Molecular Formula C31H26N6O7S
Molecular Weight 626.6 g/mol
LogP 5.9
Topological Polar Surface Area 202.0 A2
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 12
Rotatable Bonds 8
Exact Mass 626.1584
Heavy Atoms 45
Complexity 1280.0

Chemical Identifiers

CAS Number 6420-03-7
SMILES CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC(=C(C=C3)O)C(=O)O)C)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)O)C
InChIKey MKPMKGJHFHXYGK-UHFFFAOYSA-N

📖 Product Overview

2-Hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid (CAS: 6420-03-7) is a chemical compound with molecular formula C31H26N6O7S and molecular weight 626.6 g/mol. Its IUPAC systematic name is 2-hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid. LogP 5.9 Topological Polar Surface Area 202.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 12 Rotatable Bonds 8 Exact Mass 626.1584 Heavy Atoms 45 Complexity 1280.0 InChI Key: MKPMKGJHFHXYGK-UHFFFAOYSA-N. SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N=NC3=CC(=C(C=C3)O)C(=O)O)C)N=NC4C(=NN(C4=O)C5=CC=C(C=C5)S(=O)(=O)O)C.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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📚 Academic Support

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for 2-Hydroxy-5-[[2-methyl-4-[3-methyl-4-[[3-methyl-5-oxo-1-(4-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]phenyl]phenyl]diazenyl]benzoic acid.

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