3-(4-Aminophenyl)-2-Oxopropanoic Acid

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Properties Simple | Detailed

Formula C9H9NO3
IUPAC Name 3-(4-aminophenyl)-2-oxo-propanoic acid
Molecular Mass 179.173 g·mol−1
Heat of Formation -407.4 ± 16.7 kJ·mol−1
Dipole Moment 1.71 ± 1.08 D
Volume 210.1 Å 3
Surface Area 206.96 Å 2
HOMO Energy -8.54 ± 0.55 eV
LUMO Energy 2.47 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(4-aminophenyl)-2-keto-propionic acid
  • 4-amino-alpha-oxobenzenepropanoic acid
  • 4-aminophenylpyruvic acid
  • p-aminophenylpyruvic acid
  • para-aminophenylpyruvic acid
CAS Number(s)
  • 16921-36-1
InChIKey HWDZIRSKXFAMFU-UHFFFAOYSA-N
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