(2R)-N-Benzyl-2-(Isobutyrylamino)-N-Nitroso-3-Phenylpropanamide

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Properties Simple | Detailed

Formula C20H23N3O3
IUPAC Name n-[(1r)-1-benzyl-2-[benzyl(nitroso)amino]-2-oxo-ethyl]-2-methyl-propanamide
Molecular Mass 353.415 g·mol−1
Heat of Formation -220.6 ± 16.7 kJ·mol−1
Dipole Moment 3.36 ± 1.08 D
Volume 445.6 Å 3
Surface Area 349.7 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-n-[(1r)-2-(nitroso-(phenylmethyl)amino)-2-oxo-1-(phenylmethyl)ethyl]propanamide
  • 2-methyl-n-[(2r)-1-(nitroso-(phenylmethyl)amino)-1-oxo-3-phenyl-propan-2-yl]propanamide
  • 2-methyl-n-[(2r)-1-(nitroso-(phenylmethyl)amino)-1-oxo-3-phenylpropan-2-yl]propanamide
  • benzenepropanamide, alpha-((2-methyl-1-oxopropyl)amino)-n-nitroso-n-(phenylmethyl)-, (r)-
  • n'-isobutyryl-n-benzyl-n-nitrosophenylalaninamide
  • n-[(1r)-1-(benzyl)-2-(benzyl-nitroso-amino)-2-keto-ethyl]-2-methyl-propionamide
CAS Number(s)
  • 62886-02-6
InChIKey FCFSMFOBQISTAK-GOSISDBHSA-N
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