Methyl 3,3-Dimethylbutanoate

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Properties Simple | Detailed

Formula C7H14O2
IUPAC Name methyl 3,3-dimethylbutanoate
Molecular Mass 130.185 g·mol−1
Heat of Formation -494.6 ± 16.7 kJ·mol−1
Dipole Moment 1.65 ± 1.08 D
Volume 180.99 Å 3
Surface Area 178.01 Å 2
HOMO Energy -10.64 ± 0.55 eV
LUMO Energy 4.20 ± eV
Point Group Symmetry Cs
Synonyms
  • 3,3-dimethylbutanoic acid methyl ester
  • 3,3-dimethylbutyric acid methyl ester
  • butanoic acid, 3,3-dimethyl-, methyl ester
  • butyric acid, 3,3-dimethyl-, methyl ester
  • methyl 3,3-dimethylbutyrate
CAS Number(s)
  • 10250-48-3
InChIKey DXBOTVWRXLQVMG-UHFFFAOYSA-N
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Elements H C O