2-Methyl-2-Propanyl N-Formyl-L-Methionyl-D-Phenylalaninate

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Properties Simple | Detailed

Formula C19H28N2O4S
IUPAC Name tert-butyl (2r)-2-[[(2s)-2-formamido-4-methylsulfanyl-butanoyl]amino]-3-phenyl-propanoate
Molecular Mass 380.502 g·mol−1
Heat of Formation -768.5 ± 16.7 kJ·mol−1
Dipole Moment 0.45 ± 1.08 D
Volume 491.29 Å 3
Surface Area 389.79 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • (2r)-2-[[(2s)-2-formamido-4-(methylthio)-1-oxobutyl]amino]-3-phenylpropanoic acid tert-butyl ester
  • (2r)-2-[[(2s)-2-formamido-4-(methylthio)butanoyl]amino]-3-phenyl-propionic acid tert-butyl ester
  • fmp t-butyl ester
  • n-formylmethionylphenylalanine tert-butyl ester
  • t-butyl ester-n formyl-met-phe
  • tert-butyl (2r)-2-[[(2s)-2-formamido-4-methylsulfanyl-butanoyl]amino]-3-phenyl-propanoate
CAS Number(s)
  • 117014-54-7
InChIKey VWGDVNIQTWNNGP-JKSUJKDBSA-N
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