1,4-Dioxepan-5-One

Molecule SVG Image

Properties Simple | Detailed

Formula C5H8O3
IUPAC Name 1,4-dioxepan-5-one
Molecular Mass 116.115 g·mol−1
Heat of Formation -521.9 ± 16.7 kJ·mol−1
Dipole Moment 3.34 ± 1.08 D
Volume 134.18 Å 3
Surface Area 138.59 Å 2
HOMO Energy -10.56 ± 0.55 eV
LUMO Energy 3.93 ± eV
Point Group Symmetry C1
Synonyms
  • 1,4-dioxepan-2-one
  • 1,5-dioxepan-2-one
  • 1,5-dxo
CAS Number(s)
  • 35438-57-4
InChIKey AOLNDUQWRUPYGE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O