AC1L4QCA structure

AC1L4QCA

5-chloro-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid

Also Known As: Benzenesulfonic acid, 5-chloro-2-((1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)-|5-chloro-2-{(e)-[1-(2-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1h-pyrazol-4-yl]diazenyl}benzenesulfonic acid|Benzenesulfonic acid, 5-chloro-2-[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]azo]-|5-chloro-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid|Benzenesulfonic acid, 5-chloro-2-(2-(1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)diazenyl)-|5-Chloro-2-((1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl)azo)benzenesulphonic acid|5-Chloro-2-[[[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol]-4-yl]azo]benzenesulfonic acid|5-CHLORO-2-[[1-(2-CHLOROPHENYL)-4,5-DIHYDRO-3-METHYL-5-OXO-1H-PYRAZOL-4-YL]AZO]BENZENESULPHONIC ACID|5-Chloro-2-{[1-(2-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}benzene-1-sulfonic acid|5-chloro-2-{2-[1-(2-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-yl]diazen-1-yl}benzene-1-sulfonic acid|Benzenesulfonic acid, 5-chloro-2-[[1-(2-chlorophenyl) -4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl ]azo]-|Benzenesulfonic acid, 5-chloro-2-[2-[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-|Benzenesulfonic acid,5-chloro-2-[2-[1-(2-chlorophenyl)-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-4-yl]diazenyl]-

CAS: 41324-66-7
Molecular Formula C16H12Cl2N4O4S
Molecular Weight 425.99564 g/mol
LogP 3.3
Topological Polar Surface Area 120.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 7
Rotatable Bonds 4
Exact Mass 425.99564
Monoisotopic Mass 425.99564
Heavy Atoms 27
Complexity 739.0

Chemical Identifiers

CAS Number 41324-66-7
SMILES CC1=NN(C(=O)C1N=NC2=C(C=C(C=C2)Cl)S(=O)(=O)O)C3=CC=CC=C3Cl
InChIKey NVZMMVHKEJYBEU-UHFFFAOYSA-N

Product Overview

AC1L4QCA (CAS 41324-66-7), with molecular formula C16H12Cl2N4O4S and molecular weight 425.99564 g/mol. IUPAC: 5-chloro-2-[[1-(2-chlorophenyl)-3-methyl-5-oxo-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid.

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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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