2-Methyl-2-Propanyl 3,3-Dimethylbutanoate

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Properties Simple | Detailed

Formula C10H20O2
IUPAC Name tert-butyl 3,3-dimethylbutanoate
Molecular Mass 172.265 g·mol−1
Heat of Formation -598.1 ± 16.7 kJ·mol−1
Dipole Moment 1.70 ± 1.08 D
Volume 246.39 Å 3
Surface Area 228.53 Å 2
HOMO Energy -10.30 ± 0.55 eV
LUMO Energy 1.13 ± eV
Point Group Symmetry Cs
Synonyms
  • 3,3-dimethylbutanoic acid tert-butyl ester
  • 3,3-dimethylbutyric acid tert-butyl ester
  • butanoic acid, 3,3-dimethyl-, 1,1-dimethylethyl ester
CAS Number(s)
  • 69341-75-9
InChIKey JECSMAJWAQZWRS-UHFFFAOYSA-N
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Elements H C O