Propyl Butyrate

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Properties Simple | Detailed

Formula C7H14O2
IUPAC Name propyl butanoate
Molecular Mass 130.185 g·mol−1
Heat of Formation -499.1 ± 16.7 kJ·mol−1
Dipole Moment 2.01 ± 1.08 D
Volume 180.87 Å 3
Surface Area 191.01 Å 2
HOMO Energy -10.74 ± 0.55 eV
LUMO Energy 4.20 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-propyl butyrate
  • butanoic acid propyl ester
  • butanoic acid, propyl ester
  • butyric acid propyl ester
  • butyric acid, propyl ester
  • n-propyl-n-butanoate
  • propyl butyrate (natural)
  • propyl n-butyrate
  • propylbutyrate
CAS Number(s)
  • 105-66-8
InChIKey HUAZGNHGCJGYNP-UHFFFAOYSA-N
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