(4R,5R)-5-[(1S)-1-Acetamido-3-Methylbutyl]-4-(Methoxycarbonyl)-D-Proline

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Properties Simple | Detailed

Formula C14H24N2O5
IUPAC Name (2r,4r,5r)-5-[(1s)-1-acetamido-3-methyl-butyl]-4-methoxycarbonyl-pyrrolidine-2-carboxylic acid
Molecular Mass 300.351 g·mol−1
Heat of Formation -1058.2 ± 16.7 kJ·mol−1
Dipole Moment 3.05 ± 1.08 D
Volume 374.95 Å 3
Surface Area 320.09 Å 2
HOMO Energy -9.64 ± 0.55 eV
LUMO Energy 3.70 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4r,5r)-5-[(1s)-1-acetamido-3-methyl-butyl]-4-carbomethoxy-proline
  • (2r,4r,5r)-5-[(1s)-1-acetamido-3-methyl-butyl]-4-methoxycarbonyl-pyrrolidine-2-carboxylic acid
  • (2r,4r,5r)-5-[(1s)-1-acetamido-3-methylbutyl]-4-methoxycarbonyl-2-pyrrolidinecarboxylic acid
  • (2r,4r,5r)-5-[(1s)-1-acetamido-3-methylbutyl]-4-methoxycarbonylpyrrolidine-2-carboxylic acid
  • 2,4-pyrrolidinedicarboxylic acid, 5-[1-(acetylamino)-3-methylbutyl]-, 4-methyl ester, (2r,4r,5r)-
  • 5-[1-(acetylamino)-3-methylbutyl]-4-(methoxycarbonyl)proline
  • abx
InChIKey OXAVBPLKPVSWSQ-WRWGMCAJSA-N
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