Cinnamyl Butanoate

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Properties Simple | Detailed

Formula C13H16O2
IUPAC Name [(e)-cinnamyl] butanoate
Molecular Mass 204.265 g·mol−1
Heat of Formation -283.5 ± 16.7 kJ·mol−1
Dipole Moment 1.81 ± 1.08 D
Volume 267.45 Å 3
Surface Area 266.65 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy -0.17 ± eV
Point Group Symmetry C1
Synonyms
  • 3-phenyl-2-propen-1-yl butanoate
  • 3-phenyl-2-propen-1-yl butyrate
  • 3-phenyl-2-propenyl butanoate
  • 3-phenylallyl butyrate
  • 3-phenylprop-2-enyl butanoate
  • [(e)-3-phenylprop-2-enyl] butanoate
  • butanoic acid 3-phenylprop-2-enyl ester
  • butanoic acid [(e)-3-phenylprop-2-enyl] ester
  • butanoic acid, 3-phenyl-2-propenyl ester
  • butynoic acid, 3-phenyl-2-propenyl ester
  • butyric acid 3-phenylprop-2-enyl ester
  • butyric acid [(e)-3-phenylprop-2-enyl] ester
  • butyric acid, cinnamyl ester
  • cinnamyl butyrate
  • cinnamyl n-butyrate
  • phenylpropenyl n-butyrate
CAS Number(s)
  • 103-61-7
InChIKey YZYPQKZWNXANRB-UXBLZVDNSA-N
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