Propyl-2-Methylpropanoat

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Properties Simple | Detailed

Formula C7H14O2
IUPAC Name propyl 2-methylpropanoate
Molecular Mass 130.185 g·mol−1
Heat of Formation -499.8 ± 16.7 kJ·mol−1
Dipole Moment 1.84 ± 1.08 D
Volume 182.55 Å 3
Surface Area 188.3 Å 2
HOMO Energy -10.59 ± 0.55 eV
LUMO Energy 0.92 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methylpropanoic acid propyl ester
  • 2-methylpropionic acid propyl ester
  • isobutyric acid, propyl ester
  • n-propyl-2-methylpropanoate
  • propanoic acid, 2-methyl-, propyl ester
  • propyl isobutyrate
  • propyl isobutyrate (natural)
CAS Number(s)
  • 644-49-5
InChIKey AZFUASHXSOTBNU-UHFFFAOYSA-N
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Elements H C O