Methyl (2R)-3-Methyl-2-{[(2E)-3-Phenyl-2-Propenoyl]Oxy}Butanoate

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Properties Simple | Detailed

Formula C15H18O4
IUPAC Name methyl (2r)-3-methyl-2-[(e)-3-phenylprop-2-enoyl]oxy-butanoate
Molecular Mass 262.301 g·mol−1
Heat of Formation -615.2 ± 16.7 kJ·mol−1
Dipole Moment 1.95 ± 1.08 D
Volume 329.55 Å 3
Surface Area 306.68 Å 2
HOMO Energy -9.70 ± 0.55 eV
LUMO Energy -1.07 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-3-methyl-2-[(e)-1-oxo-3-phenylprop-2-enoxy]butanoic acid methyl ester
  • (2r)-3-methyl-2-[(e)-3-phenylacryloyl]oxy-butyric acid methyl ester
  • butanoic acid, 3-methyl-2-((1-oxo-3-phenyl-2-propenyl)oxy)-, methyl ester, (r-(e))-
  • methyl (2r)-3-methyl-2-[(e)-3-phenylprop-2-enoyl]oxy-butanoate
  • methyl (2r)-3-methyl-2-[(e)-3-phenylprop-2-enoyl]oxybutanoate
  • methyl 2-cinnamoyloxyisopentanoate
CAS Number(s)
  • 126518-77-2
InChIKey NCJSZYDXLJIVHG-ATWMFIQVSA-N
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