(2E)-3-[(4-Hydroxy-2-Oxobutyl)Amino]Acrylaldehyde

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Properties Simple | Detailed

Formula C7H11NO3
IUPAC Name (e)-3-[(4-hydroxy-2-oxo-butyl)amino]prop-2-enal
Molecular Mass 157.167 g·mol−1
Heat of Formation -433.8 ± 16.7 kJ·mol−1
Dipole Moment 7.31 ± 1.08 D
Volume 196.72 Å 3
Surface Area 205.92 Å 2
HOMO Energy -8.99 ± 0.55 eV
LUMO Energy 2.88 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-3-[(4-hydroxy-2-keto-butyl)amino]acrolein
  • (e)-3-[(4-hydroxy-2-oxo-butyl)amino]prop-2-enal
  • (e)-3-[(4-hydroxy-2-oxobutyl)amino]prop-2-enal
InChIKey WWFGWBHKRFILGQ-HNQUOIGGSA-N
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