AC1OA89Y

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

Also Known As: PY-191:1|J2.016.482D|4-chloro-5-methyl-2-[[3-methyl-5-oxo-1-(3-sulfophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonic acid|4-(2-Sulfo-4-methyl-5-chlorophenylazo)-1-(3-sulfophenyl)-3-methyl-1H-pyrazole-5(4H)-one|2-[1-(3-Sulfophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazole-4-ylazo]-4-chloro-5-methylbenzenesulfonic acid|4-Chloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-5-methylbenzenesulfonic acid|4-Chloro-5-methyl-2-[[3-methyl-5-oxo-1-(3-sulfophenyl)-4,5-dihydro-1H-pyrazole-4-yl]diazenyl]benzenesulfonic acid|4-Chloro-5-methyl-2-{[3-methyl-5-oxo-1-(3-sulfophenyl)-4,5-dihydro-1H-pyrazol-4-yl]diazenyl}benzene-1-sulfonic acid|4-chloro-5-methyl-2-{2-[3-methyl-5-oxo-1-(3-sulfophenyl)-4,5-dihydro-1H-pyrazol-4-yl]diazen-1-yl}benzene-1-sulfonic acid

Molecular Formula	C17H15ClN4O7S2
Molecular Weight	486.00708 g/mol
LogP	3.01682
Topological Polar Surface Area	166.13 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	8
Rotatable Bonds	5
Exact Mass	486.00708
Monoisotopic Mass	486.00708
Heavy Atoms	31
Complexity	1354.5302

Chemical Identifiers

CAS Number	185252-52-2
SMILES	CC1=CC(=C(C=C1Cl)N=NC2C(=NN(C2=O)C3=CC(=CC=C3)S(=O)(=O)O)C)S(=O)(=O)O