2,2-Dimethylpropyl Propionate

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Properties Simple | Detailed

Formula C8H16O2
IUPAC Name 2,2-dimethylpropyl propanoate
Molecular Mass 144.211 g·mol−1
Heat of Formation -525.9 ± 16.7 kJ·mol−1
Dipole Moment 2.09 ± 1.08 D
Volume 206.05 Å 3
Surface Area 200.3 Å 2
HOMO Energy -10.67 ± 0.55 eV
LUMO Energy 4.24 ± eV
Point Group Symmetry Cs
Synonyms
  • 1-propanol, 2,2-dimethyl-, propanoate
  • 1-propanol, 2,2-dimethyl-, propionate
  • propanoic acid 2,2-dimethylpropyl ester
  • propionic acid neopentyl ester
CAS Number(s)
  • 3581-69-9
InChIKey UQNDRPKPYHCNNN-UHFFFAOYSA-N
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Elements H C O