4,4-Dimethylpentanoic Acid

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Properties Simple | Detailed

Formula C7H14O2
IUPAC Name 4,4-dimethylpentanoic acid
Molecular Mass 130.185 g·mol−1
Heat of Formation -537.4 ± 16.7 kJ·mol−1
Dipole Moment 2.00 ± 1.08 D
Volume 183.07 Å 3
Surface Area 179.11 Å 2
HOMO Energy -11.10 ± 0.55 eV
LUMO Energy 3.99 ± eV
Point Group Symmetry Cs
Synonyms
  • 4,4-dimethyl valeric acid
  • 4,4-dimethyl-pentanoic acid
  • 4,4-dimethylvaleric acid
  • carboxylic acids, c6-8-neo-
  • lmfa01020144
  • neoheptanoic acid
  • pentanoic acid, 4,4-dimethyl-
CAS Number(s)
  • 1118-47-4
  • 95823-36-2
  • 33113-10-9
InChIKey HMMSZUQCCUWXRA-UHFFFAOYSA-N
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Elements H C O