Phenyloxyl Acetic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C9H8O3
IUPAC Name 3-oxo-3-phenyl-propanoic acid
Molecular Mass 164.158 g·mol−1
Heat of Formation -434.0 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 193.06 Å 3
Surface Area 193.99 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • 3-keto-3-phenyl-propionic acid
  • 3-keto-3-phenylpropionic acid
  • 3-oxo-3-phenylpropanoic acid
  • 3-oxo-3-phenylpropionic acid
  • benzenepropanoic acid, beta-oxo-
  • benzoylacetic acid
CAS Number(s)
  • 614-20-0
InChIKey HXUIDZOMTRMIOE-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O