(3E)-3-({4-[(2,6-Dimethoxy-4-Pyrimidinyl)Sulfamoyl]Phenyl}Hydrazono)-6-Oxo-1,4-Cyclohexadiene-1-Carboxylic Acid

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Properties Simple | Detailed

Formula C19H18N5O7S
IUPAC Name (3e)-3-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazinylidene]-6-oxocyclohexa-1,4-diene-1-carboxylic acid
Molecular Mass 460.441 g·mol−1
Heat of Formation -639.8 ± 16.7 kJ·mol−1
Dipole Moment 6.94 ± 1.08 D
Volume 493.04 Å 3
Surface Area 436.01 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • (3e)-3-[[4-[(2,6-dimethoxy-4-pyrimidinyl)sulfamoyl]phenyl]hydrazono]-6-oxo-1-cyclohexa-1,4-dienecarboxylic acid
  • (3e)-3-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazinylidene]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid
  • (3e)-3-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazono]-6-keto-cyclohexa-1,4-diene-1-carboxylic acid
  • (3e)-3-[[4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl]hydrazono]-6-oxo-cyclohexa-1,4-diene-1-carboxylic acid
  • 5-(n-(n-(2,4-dimethoxypyrimidinyl-6)sulfonamido)phenylazo)salicylic acid
  • benzoic acid, 5-((4-(((2,6-dimethoxy-4-pyrimidinyl)amino)sulfonyl)phenyl)azo)-2-hydroxy-
  • salasodimethoxine
  • salazodimethoxine
CAS Number(s)
  • 40016-88-4
InChIKey IQVHQJKNPDDNQR-FSJBWODESA-N
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