2-{[(2-Methoxyphenyl)Acetyl]Amino}Acrylic Acid

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Properties Simple | Detailed

Formula C12H13NO4
IUPAC Name 2-[[2-(2-methoxyphenyl)acetyl]amino]prop-2-enoic acid
Molecular Mass 235.236 g·mol−1
Heat of Formation -564.3 ± 16.7 kJ·mol−1
Dipole Moment 5.45 ± 1.08 D
Volume 283.08 Å 3
Surface Area 251.18 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -0.16 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[2-(2-methoxyphenyl)ethanoylamino]prop-2-enoic acid
  • 2-[[2-(2-methoxyphenyl)-1-oxoethyl]amino]prop-2-enoic acid
  • 2-[[2-(2-methoxyphenyl)acetyl]amino]acrylic acid
  • 2-propenoic acid, 2-(((2-methoxyphenyl)acetyl)amino)-
  • ad 20
  • o-methoxyphenylacetyl dehydroalanine
CAS Number(s)
  • 111542-07-5
InChIKey JJLSSLSXTRMIGR-UHFFFAOYSA-N
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