N-[(2-Chloroethyl)(Nitroso)Carbamoyl]Glycine

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Properties Simple | Detailed

Formula C5H8ClN3O4
IUPAC Name 2-[[2-chloroethyl(nitroso)carbamoyl]amino]acetic acid
Molecular Mass 209.588 g·mol−1
Heat of Formation -577.0 ± 16.7 kJ·mol−1
Dipole Moment 2.95 ± 1.08 D
Volume 221.14 Å 3
Surface Area 216.16 Å 2
HOMO Energy -10.56 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(2-chloroethyl-nitroso-carbamoyl)amino]acetic acid
  • 2-[(2-chloroethyl-nitroso-carbamoyl)amino]ethanoic acid
  • 2-[(2-chloroethyl-nitrosocarbamoyl)amino]acetic acid
  • 2-[[(2-chloroethyl-nitrosoamino)-oxomethyl]amino]acetic acid
  • cnc-ga
  • glycine, n-(((2-chloroethyl)nitrosoamino)carbonyl)-
CAS Number(s)
  • 80687-06-5
InChIKey KQQQWIYFYYPIDZ-UHFFFAOYSA-N
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Elements H C N O Cl