S-(2-Hydroxyethyl)-L-Homocysteine

Molecule SVG Image

Properties Simple | Detailed

Formula C6H13NO3S
IUPAC Name (2s)-2-amino-4-(2-hydroxyethylsulfanyl)butanoic acid
Molecular Mass 179.237 g·mol−1
Heat of Formation -589.3 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 215.32 Å 3
Surface Area 207.41 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-4-(2-hydroxyethylsulfanyl)butanoic acid
  • (2s)-2-amino-4-(2-hydroxyethylthio)butanoic acid
  • (2s)-2-amino-4-(2-hydroxyethylthio)butyric acid
  • l-homocysteine, s-(2-hydroxyethyl)-
  • s-hydroxyethylhomocysteine
CAS Number(s)
  • 61473-66-3
InChIKey WKECILUJKOJNGE-YFKPBYRVSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N