Chem
J-GLOBAL ID:200907039223384432   Nikkaji number:J68.939D

3-Methyl-1-(2,5-disulfophenyl)-2-pyrazolin-5-one

3-メチル-1-(2,5-ジスルホフェニル)-2-ピラゾリン-5-オン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C10H10N2O7S2
Molecular formula furigana: C10-H10-N2-O7-S2
Molecular weight: 334.320
InChI: InChI=1S/C10H10N2O7S2/c1-6-4-10(13)12(11-6)8-5-7(20(14,15)16)2-3-9(8)21(17,18)19/h2-3,5H,4H2,1H3,(H,14,15,16)(H,17,18,19)
InChI key: ZGXJVLAIEZQGHY-UHFFFAOYSA-N
SMILES: CC1=NN(C(=O)C1)c1cc(ccc1S(=O)(=O)O)S(=O)(=O)O
Systematic name  (3):
  • 3-メチル-1-(2,5-ジスルホフェニル)-2-ピラゾリン-5-オン
  • 2-(3-メチル-5-オキソ-4,5-ジヒドロ-1H-ピラゾール-1-イル)ベンゼン-1,4-ジスルホン酸
  • 2-(3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzene-1,4-disulfonic acid
Other name (1):
  • 3-Methyl-1-(2,5-disulfophenyl)-2-pyrazolin-5-one
CAS registry number: 54817-63-9
Regulation number (2):
  • (5)-365
  • EINECS2593625
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