N-[(2E)-3-(2-Furyl)-2-Propenoyl]-L-Phenylalanine

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Properties Simple | Detailed

Formula C16H15NO4
IUPAC Name (2s)-2-[[(e)-3-(2-furyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid
Molecular Mass 285.295 g·mol−1
Heat of Formation -437.4 ± 16.7 kJ·mol−1
Dipole Moment 4.38 ± 1.08 D
Volume 340.43 Å 3
Surface Area 308.5 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy -0.90 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(e)-3-(2-furyl)-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid
  • (2s)-2-[[(e)-3-(2-furyl)acryloyl]amino]-3-phenyl-propionic acid
  • (2s)-2-[[(e)-3-(2-furyl)prop-2-enoyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[[(e)-3-furan-2-ylprop-2-enoyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[[(e)-3-furan-2-ylprop-2-enoyl]amino]-3-phenylpropanoic acid
  • fa-phe
  • l-phenylalanine, n-(3-(2-furanyl)-1-oxo-2-propenyl)-, (e)-
  • n-(3-(2-furyl)acryloyl)phenylalanine
CAS Number(s)
  • 4950-66-7
InChIKey QSMRHXUZHXEHBK-VFNNOXKTSA-N
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