2-[Methyl(Nitroso)Amino]Ethyl 4-Methylbenzenesulfonate

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Formula C10H14N2O4S
IUPAC Name 2-[methyl(nitroso)amino]ethyl 4-methylbenzenesulfonate
Molecular Mass 258.294 g·mol−1
Heat of Formation -421.4 ± 16.7 kJ·mol−1
Dipole Moment 8.60 ± 1.08 D
Volume 289.8 Å 3
Surface Area 280.5 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.70 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(methyl-nitroso-amino)ethyl 4-methylbenzenesulfonate
  • 2-(methyl-nitrosoamino)ethyl 4-methylbenzenesulfonate
  • 2-(methylnitrosoamino)ethanol 4-methylbenzenesulfonate (ester)
  • 4-methylbenzenesulfonic acid 2-(methyl-nitroso-amino)ethyl ester
  • 4-methylbenzenesulfonic acid 2-(methyl-nitrosoamino)ethyl ester
  • ethanol, 2-(methylnitrosoamino)-, 4-methylbenzenesulfonate (ester)
  • n-nitrosomethyl-(2-hydroxyethyl)amine 4-toluenesulfonate ester
  • n-nitrosomethyl-(2-hydroxyethyl)amine p-toluenesulfonate ester
  • n-nitrosomethyl-(2-tosyloxyethyl) amine
CAS Number(s)
  • 66398-63-8
InChIKey SUJOMVHQTCCFTH-UHFFFAOYSA-N
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