N-[3-(2-Amino-5-Methoxyphenyl)-3-Oxopropyl]Acetamide

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Properties Simple | Detailed

Formula C12H16N2O3
IUPAC Name n-[3-(2-amino-5-methoxy-phenyl)-3-oxo-propyl]acetamide
Molecular Mass 236.267 g·mol−1
Heat of Formation -479.8 ± 16.7 kJ·mol−1
Dipole Moment 5.79 ± 1.08 D
Volume 285.09 Å 3
Surface Area 270.57 Å 2
HOMO Energy -8.25 ± 0.55 eV
LUMO Energy 2.28 ± eV
Point Group Symmetry C1
Synonyms
  • acetamide, n-(3-(2-amino-5-methoxyphenyl)-3-oxopropyl)-
  • amka
  • n(gamma)-acetyl-5-methoxykynurenamine
  • n-[3-(2-amino-5-methoxy-phenyl)-3-keto-propyl]acetamide
  • n-[3-(2-amino-5-methoxy-phenyl)-3-oxo-propyl]acetamide
  • n-[3-(2-amino-5-methoxy-phenyl)-3-oxo-propyl]ethanamide
  • n-acetyl-5-methoxy kynurenamine
CAS Number(s)
  • 52450-39-2
InChIKey RJQIZOKNUKRKTP-UHFFFAOYSA-N
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