(2S,3R)-4-Methoxy-4-Oxo-2,3-Disulfanylbutanoic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C5H8O4S2
IUPAC Name (2s,3r)-4-methoxy-4-oxo-2,3-bis(sulfanyl)butanoic acid
Molecular Mass 196.245 g·mol−1
Heat of Formation -729.1 ± 16.7 kJ·mol−1
Dipole Moment 1.87 ± 1.08 D
Volume 211.13 Å 3
Surface Area 199.62 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r)-2,3-dimercapto-4-methoxy-4-oxobutanoic acid
  • (2s,3r)-4-keto-2,3-dimercapto-4-methoxy-butyric acid
  • (2s,3r)-4-methoxy-4-oxo-2,3-bis-sulfanyl-butanoic acid
  • (2s,3r)-4-methoxy-4-oxo-2,3-bis-sulfanylbutanoic acid
  • (r*,s*)-monomethyl 2,3-dimercaptobutanedioate
  • butanedioic acid, 2,3-dimercapto-, monomethyl ester, (r*,s*)-
  • dimercaptosuccinic acid monomethyl ester
  • mome-dmsa
CAS Number(s)
  • 73618-85-6
InChIKey GELAOSIUBCMYGY-GBXIJSLDSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O