4,4-Dimethyl-1,2-Dioxetan-3-One

Molecule SVG Image

Properties Simple | Detailed

Formula C4H6O3
IUPAC Name 4,4-dimethyldioxetan-3-one
Molecular Mass 102.089 g·mol−1
Heat of Formation -199.4 ± 16.7 kJ·mol−1
Dipole Moment 3.41 ± 1.08 D
Volume 120.02 Å 3
Surface Area 129.18 Å 2
HOMO Energy -10.66 ± 0.55 eV
LUMO Energy 2.80 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,2-dioxetan-3-one, 4,4-dimethyl-
  • 4,4-dimethyl-3-dioxetanone
  • dimethyldioxetanone
CAS Number(s)
  • 39605-37-3
InChIKey MHUUEDKTLIMBPS-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O