Isopropyl Propanoate

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Properties Simple | Detailed

Formula C6H12O2
IUPAC Name isopropyl propanoate
Molecular Mass 116.158 g·mol−1
Heat of Formation -492.0 ± 16.7 kJ·mol−1
Dipole Moment 1.97 ± 1.08 D
Volume 159.36 Å 3
Surface Area 167.33 Å 2
HOMO Energy -10.65 ± 0.55 eV
LUMO Energy 0.98 ± eV
Point Group Symmetry C1
Synonyms
  • 1-methylethyl propanoate
  • isopropyl propionate
  • isopropyl propionate [un2409] [flammable liquid]
  • propan-2-yl propanoate
  • propanoic acid isopropyl ester
  • propanoic acid, 1-methylethyl ester
  • propionic acid isopropyl ester
  • propionic acid, isopropyl ester
CAS Number(s)
  • 637-78-5
InChIKey IJMWOMHMDSDKGK-UHFFFAOYSA-N
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