(3Z)-3-Hexen-1-Yl Acetate

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Properties Simple | Detailed

Formula C8H14O2
IUPAC Name [(z)-hex-3-enyl] acetate
Molecular Mass 142.196 g·mol−1
Heat of Formation -416.8 ± 16.7 kJ·mol−1
Dipole Moment 2.41 ± 1.08 D
Volume 198.87 Å 3
Surface Area 195.72 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 4.12 ± eV
Point Group Symmetry C1
Synonyms
  • (3z)-c-3-hexenyl acetate
  • (z)-3-hexenyl acetate
  • (z)-hex-3-enyl acetate
  • 3-hexen-1-ol, acetate, (3z)-
  • 3-hexen-1-ol, acetate, (z)-
  • 3-hexenyl acetate, (z)-
  • 3-hexenyl acetate, cis-
  • [(z)-hex-3-enyl] acetate
  • [(z)-hex-3-enyl] ethanoate
  • acetic acid [(z)-hex-3-enyl] ester
  • cis-3-hexen-1-yl acetate
  • cis-3-hexen-1-yl acetate (natural)
  • cis-3-hexenol acetate
  • cis-3-hexenyl acetate
  • cis-3-hexenyl ethanoate
  • leaf acetate
CAS Number(s)
  • 25152-87-8
  • 3681-71-8
InChIKey NPFVOOAXDOBMCE-PLNGDYQASA-N
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