(6E)-6-(1,3-Benzoxazol-2(3H)-Ylidene)-2,4-Cyclohexadien-1-One

Molecule SVG Image

Properties Simple | Detailed

Formula C13H9NO2
IUPAC Name (6e)-6-(1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one
Molecular Mass 211.216 g·mol−1
Heat of Formation -9.9 ± 16.7 kJ·mol−1
Dipole Moment 4.67 ± 1.08 D
Volume 236.95 Å 3
Surface Area 229.65 Å 2
HOMO Energy -8.37 ± 0.55 eV
LUMO Energy -1.43 ± eV
Point Group Symmetry Cs
Synonyms
  • (6e)-6-(3h-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienone
  • (6e)-6-(3h-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one
  • 2-(2-hydroxyphenyl)benzoxazole
  • 2-(o-hydroxyphenyl)benzoxazole
  • 6-(3h-1,3-benzoxazol-2-ylidene)-1-cyclohexa-2,4-dienone
  • 6-(3h-1,3-benzoxazol-2-ylidene)cyclohexa-2,4-dien-1-one
  • phenol, 2-(2-benzoxazolyl)-
  • phenol, o-2-benzoxazolyl-
  • usaf ek-6754
CAS Number(s)
  • 835-64-3
InChIKey UWUSYRFTCSSHAJ-UKTHLTGXSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N