Tert-Butyl Pentanoate

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Properties Simple | Detailed

Formula C9H18O2
IUPAC Name tert-butyl pentanoate
Molecular Mass 158.238 g·mol−1
Heat of Formation -569.6 ± 16.7 kJ·mol−1
Dipole Moment 1.81 ± 1.08 D
Volume 224.74 Å 3
Surface Area 221.12 Å 2
HOMO Energy -10.44 ± 0.55 eV
LUMO Energy 4.37 ± eV
Point Group Symmetry Cs
Synonyms
  • pentanoic acid tert-butyl ester
  • pentanoic acid, 1,1-dimethylethyl ester
  • valeric acid tert-butyl ester
InChIKey SCSLUABEVMLYEA-UHFFFAOYSA-N
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Elements H C O