5-Hydroxy-2-{[(2E)-3-(4-Hydroxy-3-Methoxyphenyl)-2-Propenoyl]Amino}Benzoic Acid

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Properties Simple | Detailed

Formula C17H15NO6
IUPAC Name 5-hydroxy-2-[[(e)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid
Molecular Mass 329.304 g·mol−1
Heat of Formation -817.8 ± 16.7 kJ·mol−1
Dipole Moment 3.11 ± 1.08 D
Volume 365.69 Å 3
Surface Area 342.16 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.31 ± eV
Point Group Symmetry C1
Synonyms
  • 5-hydroxy-2-[[(e)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]amino]benzoic acid
  • 5-hydroxy-2-[[(e)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]amino]benzoic acid
  • 5-hydroxy-2-[[(e)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid
  • 5-hydroxy-2-[[(e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino]benzoic acid
InChIKey JXFZHMCSCYADIX-XVNBXDOJSA-N
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