[Methyl(Nitroso)Amino]Methyl Butyrate

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Properties Simple | Detailed

Formula C6H12N2O3
IUPAC Name [methyl(nitroso)amino]methyl butanoate
Molecular Mass 160.171 g·mol−1
Heat of Formation -406.1 ± 16.7 kJ·mol−1
Dipole Moment 5.08 ± 1.08 D
Volume 200.32 Å 3
Surface Area 200.64 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 3.27 ± eV
Point Group Symmetry C1
Synonyms
  • (methyl-nitroso-amino)methyl butanoate
  • (methyl-nitrosoamino)methyl butanoate
  • butanoic acid (methyl-nitrosoamino)methyl ester
  • butyric acid (methyl-nitroso-amino)methyl ester
  • butyric acid, methylnitrosamino methyl ester
  • methyl(butyroxymethyl)nitrosamine
  • methylamine, n-(1-butyroxymethyl)-n-nitroso-
  • n-(1-butyroxymethyl)methylnitrosamine
  • n-nitroso-n-(1-butyroxymethyl)methyl amine
CAS Number(s)
  • 67557-56-6
InChIKey QYSCDYCXQPWICC-UHFFFAOYSA-N
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