2-Hydroxy-4-[({[(4-Methylphenyl)Sulfonyl]Oxy}Acetyl)Amino]Benzoic Acid

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Properties Simple | Detailed

Formula C16H15NO7S
IUPAC Name 2-hydroxy-4-[[2-(p-tolylsulfonyloxy)acetyl]amino]benzoic acid
Molecular Mass 365.358 g·mol−1
Heat of Formation -1081.1 ± 16.7 kJ·mol−1
Dipole Moment 5.83 ± 1.08 D
Volume 387.92 Å 3
Surface Area 362.52 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy -0.83 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-4-[2-(4-methylphenyl)sulfonyloxyethanoylamino]benzoic acid
  • 2-hydroxy-4-[[2-(4-methylphenyl)sulfonyloxy-1-oxoethyl]amino]benzoic acid
InChIKey HWNUSGNZBAISFM-UHFFFAOYSA-N
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