(2S)-2-Benzyl-3-Sulfanylpropanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C10H12O2S
IUPAC Name (2s)-2-benzyl-3-sulfanyl-propanoic acid
Molecular Mass 196.266 g·mol−1
Heat of Formation -319.9 ± 16.7 kJ·mol−1
Dipole Moment 0.86 ± 1.08 D
Volume 242.25 Å 3
Surface Area 222.38 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy -0.88 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-(benzyl)-3-mercapto-propionic acid
  • (2s)-2-(mercaptomethyl)-3-phenylpropanoic acid
  • (2s)-2-(phenylmethyl)-3-sulfanyl-propanoic acid
  • (2s)-2-(phenylmethyl)-3-sulfanylpropanoic acid
  • 2-thiomethyl-3-phenylpropanoic acid
  • btp
InChIKey ZUEBVBPVXLQMQR-SECBINFHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O