(2S)-2-{[(2R)-2-Ammonio-4-Methylpentanoyl]Amino}Propanoate

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Properties Simple | Detailed

Formula C9H18N2O3
IUPAC Name (2s)-2-[[(2r)-2-amino-4-methyl-pentanoyl]amino]propanoic acid
Molecular Mass 202.251 g·mol−1
Heat of Formation -667.5 ± 16.7 kJ·mol−1
Dipole Moment 5.39 ± 1.08 D
Volume 264.79 Å 3
Surface Area 247.13 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 3.67 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2r)-2-ammonio-4-methyl-1-oxopentyl]amino]propanoate
  • (2s)-2-[[(2r)-2-ammonio-4-methyl-pentanoyl]amino]propionate
  • (2s)-2-[[(2r)-2-azaniumyl-4-methyl-pentanoyl]amino]propanoate
InChIKey HSQGMTRYSIHDAC-NKWVEPMBSA-N
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