3-Phenyl-3-Buten-1-Yl Acetate

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Properties Simple | Detailed

Formula C12H14O2
IUPAC Name 3-phenylbut-3-enyl acetate
Molecular Mass 190.238 g·mol−1
Heat of Formation -267.5 ± 16.7 kJ·mol−1
Dipole Moment 1.89 ± 1.08 D
Volume 252.88 Å 3
Surface Area 231.79 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 0.14 ± eV
Point Group Symmetry C1
Synonyms
  • 3-phenylbut-3-enyl ethanoate
  • acetic acid 3-phenylbut-3-enyl ester
  • benzenepropanol, 2-methylene-, acetate
  • benzenepropanol, gamma-methylene-, acetate
CAS Number(s)
  • 7306-12-9
InChIKey RIKRCGVPSVKZJW-UHFFFAOYSA-N
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