3-(4-Hydroxy-3-Methoxyphenyl)-2-Oxopropanoic Acid

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Properties Simple | Detailed

Formula C10H10O5
IUPAC Name 3-(4-hydroxy-3-methoxy-phenyl)-2-oxo-propanoic acid
Molecular Mass 210.183 g·mol−1
Heat of Formation -744.6 ± 16.7 kJ·mol−1
Dipole Moment 2.67 ± 1.08 D
Volume 239.3 Å 3
Surface Area 229.61 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.86 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-hydroxy-3-methoxy-phenyl)-2-keto-propionic acid
  • 3-methoxy-4-hydroxyphenylpyruvic acid
  • 4- hydroxy-3-methoxy-alpha-oxobenzenepropanoic acid
  • 4-hydroxy-3-methoxyphenyl)pyruvic acid
  • 4-hydroxy-3-methoxyphenylpyruvic acid
  • bbv-021141
  • hmppa cpd
  • phenylacetylformic acid, 4-hydroxy-3-methoxy-
  • phenylacetylformic acid, 4-hydroxy-5-methoxy-
  • vanilpyruvic acid
CAS Number(s)
  • 1081-71-6
InChIKey YGQHQTMRZPHIBB-UHFFFAOYSA-N
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