N~6~-[(2-Chloroethyl)(Nitroso)Carbamoyl]-L-Lysine

Molecule SVG Image

Properties Simple | Detailed

Formula C9H17ClN4O4
IUPAC Name (2s)-2-amino-6-[[2-chloroethyl(nitroso)carbamoyl]amino]hexanoic acid
Molecular Mass 280.709 g·mol−1
Heat of Formation -629.5 ± 16.7 kJ·mol−1
Dipole Moment 6.44 ± 1.08 D
Volume 324.11 Å 3
Surface Area 303.56 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-amino-6-[(2-chloroethyl-nitroso-carbamoyl)amino]hexanoic acid
  • (2s)-2-amino-6-[(2-chloroethyl-nitrosocarbamoyl)amino]hexanoic acid
  • (2s)-2-amino-6-[[(2-chloroethyl-nitrosoamino)-oxomethyl]amino]hexanoic acid
  • cnc-omega-lys
  • l-lysine, n6-(((2-chloroethyl)nitrosoamino)carbonyl)-
  • n-(2-chloroethyl)-n-nitrosocarbamoyl-omega-lysine
CAS Number(s)
  • 87494-15-3
InChIKey DCEFQPAYXOBNGC-ZETCQYMHSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N O Cl