(3,4-Difluorophenyl)Acetic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C8H6F2O2
IUPAC Name 2-(3,4-difluorophenyl)acetic acid
Molecular Mass 172.129 g·mol−1
Heat of Formation -685.9 ± 16.7 kJ·mol−1
Dipole Moment 3.58 ± 1.08 D
Volume 185.46 Å 3
Surface Area 184.76 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy -0.93 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(3,4-difluorophenyl)ethanoic acid
  • 3,4-difluorophenylacetic acid
  • benzeneacetic acid, 3,4-difluoro-
  • jrd-0217
CAS Number(s)
  • 658-93-5
InChIKey YCAKYFIYUHHCKW-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O F