N-[(1S)-1-(4-Methoxy-2-Oxo-2H-Pyran-6-Yl)-2-Phenylethyl]Acetamide

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Properties Simple | Detailed

Formula C16H17NO4
IUPAC Name n-[(1s)-1-(4-methoxy-6-oxo-pyran-2-yl)-2-phenyl-ethyl]acetamide
Molecular Mass 287.310 g·mol−1
Heat of Formation -551.4 ± 16.7 kJ·mol−1
Dipole Moment 2.32 ± 1.08 D
Volume 348.39 Å 3
Surface Area 305.26 Å 2
HOMO Energy -9.57 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • 4-methoxy-6-(1'-acetamido-2'-phenylethyl)-2h-pyran-2-one
  • acetamide, n-(1-(4-methoxy-2-oxo-2h-pyran-6-yl)-2-phenylethyl)-, (s)-
  • acon0_001053
  • acon1_001805
  • megxm0_000056
  • n-[(1s)-1-(4-methoxy-6-oxo-2-pyranyl)-2-phenylethyl]acetamide
  • n-[(1s)-1-(4-methoxy-6-oxo-pyran-2-yl)-2-phenyl-ethyl]acetamide
  • n-[(1s)-1-(4-methoxy-6-oxo-pyran-2-yl)-2-phenyl-ethyl]ethanamide
  • n-[(1s)-1-(4-methoxy-6-oxopyran-2-yl)-2-phenylethyl]acetamide
  • n-[(1s)-1-(6-keto-4-methoxy-pyran-2-yl)-2-phenyl-ethyl]acetamide
CAS Number(s)
  • 131190-56-2
InChIKey VFMQMACUYWGDOJ-AWEZNQCLSA-N
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