S-(5-Acetamido-2-Hydroxyphenyl)-L-Cysteine

Molecule SVG Image

Properties Simple | Detailed

Formula C11H14N2O4S
IUPAC Name (2r)-3-(5-acetamido-2-hydroxy-phenyl)sulfanyl-2-amino-propanoic acid
Molecular Mass 270.305 g·mol−1
Heat of Formation -644.7 ± 16.7 kJ·mol−1
Dipole Moment 4.69 ± 1.08 D
Volume 307.82 Å 3
Surface Area 287.58 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-3-(5-acetamido-2-hydroxy-phenyl)sulfanyl-2-amino-propanoic acid
  • (2r)-3-[(5-acetamido-2-hydroxy-phenyl)thio]-2-amino-propionic acid
  • (2r)-3-[(5-acetamido-2-hydroxyphenyl)thio]-2-aminopropanoic acid
  • 3-(cystein-s-yl)acetaminophen
  • 3-(cystein-s-yl)paracetamol
  • l-cysteine, s-(5-(acetylamino)-2-hydroxyphenyl)-
CAS Number(s)
  • 53446-10-9
InChIKey LLHICPSCVFRWDT-QMMMGPOBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H S C O N