Isopropyl 2,2-Dimethylbutanoate

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Properties Simple | Detailed

Formula C9H18O2
IUPAC Name isopropyl 2,2-dimethylbutanoate
Molecular Mass 158.238 g·mol−1
Heat of Formation -556.5 ± 16.7 kJ·mol−1
Dipole Moment 2.24 ± 1.08 D
Volume 227.45 Å 3
Surface Area 209.75 Å 2
HOMO Energy -10.35 ± 0.55 eV
LUMO Energy 1.03 ± eV
Point Group Symmetry C1
Synonyms
  • 2,2-dimethylbutanoic acid isopropyl ester
  • 2,2-dimethylbutyric acid isopropyl ester
  • propan-2-yl 2,2-dimethylbutanoate
InChIKey BSQKFTUIWLMBMZ-UHFFFAOYSA-N
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Elements H C O