1-(2′,5′-Dichloro-4′-sulfophenyl)-3-methyl-5-pyrazolone
Properties
- Molecular formula
- C10H8Cl2N2O4S
- Molar mass
- 323.14 g/mol
- Exact mass
- 321.9582 Da
- logP
- 2.35Crippen estimate
- Polar surface area
- 87.0 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 2
Identifiers
CAS number
84-57-1SMILES
CC1=NN(c2cc(Cl)c(S(=O)(=O)O)cc2Cl)C(=O)C1InChIKey
KCEIVWKDBLAQKL-UHFFFAOYSA-NInChI
InChI=1S/C10H8Cl2N2O4S/c1-5-2-10(15)14(13-5)8-3-7(12)9(4-6(8)11)19(16,17)18/h3-4H,2H2,1H3,(H,16,17,18)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
9 names
- Benzenesulfonic acid, 2,5-dichloro-4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-
- Benzenesulfonic acid, 2,5-dichloro-4-(3-methyl-5-oxo-2-pyrazolin-1-yl)-
- 2,5-Dichloro-4-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulfonic acid
- 2,5-Dichloro-4-(3-methyl-5-oxo-2-pyrazolin-1-yl)benzenesulfonic acid
- 1-(2′,5′-Dichloro)phenyl-3-methyl-5-pyrazolone-4′-sulfonic acid
- 1-(2,5-Dichloro-4-sulfophenyl)-3-methyl-5-pyrazolone
- p-(3-Methyl-5-oxo-2-pyrazolin-1-yl)-2,5-dichlorbenzenesulfonic acid
- NSC 50666
- 2,5-Dichloro-4-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid