2-Oxo-3-(Pentylsulfanyl)Propanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C8H14O3S
IUPAC Name 2-oxo-3-pentylsulfanyl-propanoic acid
Molecular Mass 190.260 g·mol−1
Heat of Formation -570.2 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 237.2 Å 3
Surface Area 238.38 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-oxo-3-(pentylthio)propanoic acid
  • 3-(amylthio)-2-keto-propionic acid
  • 3-(pentylthio)pyruvic acid
  • propanoic acid, 2-oxo-3-(pentylthio)-
CAS Number(s)
  • 50722-34-4
InChIKey VEUXIBFYPWYDLD-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O