Isobutyric Acid, Cinnamyl Ester

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Properties Simple | Detailed

Formula C13H16O2
IUPAC Name [(e)-cinnamyl] 2-methylpropanoate
Molecular Mass 204.265 g·mol−1
Heat of Formation -285.0 ± 16.7 kJ·mol−1
Dipole Moment 1.69 ± 1.08 D
Volume 268.61 Å 3
Surface Area 264.51 Å 2
HOMO Energy -9.25 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-propanoic acid, 3-phenyl-2-propenyl ester
  • 2-methylpropanoic acid 3-phenylprop-2-enyl ester
  • 2-methylpropanoic acid [(e)-3-phenylprop-2-enyl] ester
  • 2-methylpropionic acid 3-phenylprop-2-enyl ester
  • 2-methylpropionic acid [(e)-3-phenylprop-2-enyl] ester
  • 3-phenyl-2-propen-1-yl 2-methylpropanoate
  • 3-phenyl-2-propen-1-yl isobutyrate
  • 3-phenylprop-2-enyl 2-methylpropanoate
  • [(e)-3-phenylprop-2-enyl] 2-methylpropanoate
  • cinnamyl 2-methylpropanoate
  • cinnamyl isobutyrate
  • propanoic acid, 2-methyl-, 3-phenyl-2-propenyl ester
CAS Number(s)
  • 103-59-3
InChIKey KLKQSZIWHVEARN-RMKNXTFCSA-N
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