2,5-Dioxo-1-Pyrrolidinyl N-(Pentafluorobenzoyl)-L-Methionylglycinate

Molecule SVG Image

Properties Simple | Detailed

Formula C18H16F5N3O6S
IUPAC Name (2,5-dioxopyrrolidin-1-yl) 2-[[(2s)-4-methylsulfanyl-2-[(2,3,4,5,6-pentafluorobenzoyl)amino]butanoyl]amino]acetate
Molecular Mass 497.393 g·mol−1
Heat of Formation -1702.6 ± 16.7 kJ·mol−1
Dipole Moment 5.41 ± 1.08 D
Volume 517.37 Å 3
Surface Area 419.06 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -1.68 ± eV
Point Group Symmetry C1
Synonyms
  • (2,5-dioxopyrrolidin-1-yl) 2-[[(2s)-4-methylsulfanyl-2-[(2,3,4,5,6-pentafluorophenyl)carbonylamino]butanoyl]amino]ethanoate
  • 2,5-pyrrolidinedione, 1-((n-(n-(pentafluorobenzoyl)-l-methionyl)glycyl)oxy)-
  • 2-[[(2s)-4-(methylthio)-1-oxo-2-[[oxo-(2,3,4,5,6-pentafluorophenyl)methyl]amino]butyl]amino]acetic acid (2,5-dioxo-1-pyrrolidinyl) ester
  • 2-[[(2s)-4-(methylthio)-2-[(2,3,4,5,6-pentafluorobenzoyl)amino]butanoyl]amino]acetic acid succinimido ester
  • n-pentafluorobenzoylmethionylglycine-n-hydroxysuccinimide ester
  • n-pfb-met-gly-nhs
  • npmgn
CAS Number(s)
  • 83800-45-7
InChIKey HZCMYWNNRKQTET-ZETCQYMHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements C F H O N S