Propyl Propanoate

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Properties Simple | Detailed

Formula C6H12O2
IUPAC Name propyl propanoate
Molecular Mass 116.158 g·mol−1
Heat of Formation -477.0 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 158.6 Å 3
Surface Area 170.78 Å 2
HOMO Energy -10.74 ± 0.55 eV
LUMO Energy 4.21 ± eV
Point Group Symmetry Cs
Synonyms
  • n-propyl propanoate
  • n-propyl propionate
  • propanoic acid propyl ester
  • propanoic acid, propyl ester
  • propionic acid propyl ester
  • propionic acid, propyl ester
  • propyl propionate
  • propyl propionate (natural)
CAS Number(s)
  • 106-36-5
InChIKey MCSINKKTEDDPNK-UHFFFAOYSA-N
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Elements H C O