Isobutyl Acetate

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Properties Simple | Detailed

Formula C6H12O2
IUPAC Name isobutyl acetate
Molecular Mass 116.158 g·mol−1
Heat of Formation -451.0 ± 16.7 kJ·mol−1
Dipole Moment 4.84 ± 1.08 D
Volume 161.39 Å 3
Surface Area 167.68 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy 4.18 ± eV
Point Group Symmetry C1
Synonyms
  • .beta.-methylpropyl ethanoate
  • 2-methyl-1-propyl acetate
  • 2-methylpropyl acetate
  • 2-methylpropyl ethanoate
  • acetate d'isobutyle
  • acetic acid isobutyl ester
  • acetic acid, 2-methylpropyl ester
  • acetic acid, isobutyl ester
  • beta-methylpropyl ethanoate
  • isobutyl acetate (natural)
  • isobutyl acetate [un1213] [flammable liquid]
  • isobutyl ethanoate
CAS Number(s)
  • 110-19-0
InChIKey GJRQTCIYDGXPES-UHFFFAOYSA-N
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