Neopentylene Formal

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Properties Simple | Detailed

Formula C6H12O2
IUPAC Name 5,5-dimethyl-1,3-dioxane
Molecular Mass 116.158 g·mol−1
Heat of Formation -414.7 ± 16.7 kJ·mol−1
Dipole Moment 2.36 ± 1.08 D
Volume 153.98 Å 3
Surface Area 151.0 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3-dioxane, 5,5-dimethyl-
  • 5,5-dimethyl-m-dioxane
  • fr-1059
  • m-dioxane, 5,5-dimethyl-
CAS Number(s)
  • 872-98-0
InChIKey QDCJIPFNVBDLRH-UHFFFAOYSA-N
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Elements H C O