4-(2,2-Dimethylpropanoyl)Benzoic Acid

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Properties Simple | Detailed

Formula C12H14O3
IUPAC Name 4-(2,2-dimethylpropanoyl)benzoic acid
Molecular Mass 206.238 g·mol−1
Heat of Formation -517.6 ± 16.7 kJ·mol−1
Dipole Moment 3.20 ± 1.08 D
Volume 259.25 Å 3
Surface Area 234.72 Å 2
HOMO Energy -10.15 ± 0.55 eV
LUMO Energy 2.04 ± eV
Point Group Symmetry C1
Synonyms
  • 4-(2,2-dimethyl-1-oxopropyl)benzoic acid
  • 4-pivaloylbenzoic acid
  • ae-562/43287035
InChIKey NNZDOYSFYZZHFV-UHFFFAOYSA-N
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Elements H C O