N-[(1S)-1-Formamidoethyl]-N~2~-{[(2-Methyl-2-Propanyl)Oxy]Carbonyl}-L-Alaninamide

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Properties Simple | Detailed

Formula C11H21N3O4
IUPAC Name tert-butyl n-[(1s)-2-[[(1s)-1-formamidoethyl]amino]-1-methyl-2-oxo-ethyl]carbamate
Molecular Mass 259.302 g·mol−1
Heat of Formation -875.4 ± 16.7 kJ·mol−1
Dipole Moment 4.45 ± 1.08 D
Volume 329.29 Å 3
Surface Area 304.73 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy 3.67 ± eV
Point Group Symmetry C1
Synonyms
  • (tert-butyloxycarbonyl)-alanyl-amino ethyl-formamide
  • n-[(1s)-2-[[(1s)-1-formamidoethyl]amino]-1-methyl-2-oxoethyl]carbamic acid tert-butyl ester
  • n-[(1s)-2-[[(1s)-1-formamidoethyl]amino]-2-keto-1-methyl-ethyl]carbamic acid tert-butyl ester
  • tert-butyl n-[(1s)-2-[[(1s)-1-formamidoethyl]amino]-1-methyl-2-oxo-ethyl]carbamate
  • tert-butyl n-[(2s)-1-[[(1s)-1-formamidoethyl]amino]-1-oxo-propan-2-yl]carbamate
InChIKey MNUWNIQGBRBQRE-YUMQZZPRSA-N
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