4-{[(2S)-2,4-Dihydroxy-3,3-Dimethylbutanoyl]Amino}Butanoic Acid

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Properties Simple | Detailed

Formula C10H19NO5
IUPAC Name 4-[[(2s)-2,4-dihydroxy-3,3-dimethyl-butanoyl]amino]butanoic acid
Molecular Mass 233.262 g·mol−1
Heat of Formation -1072.0 ± 16.7 kJ·mol−1
Dipole Moment 5.51 ± 1.08 D
Volume 291.51 Å 3
Surface Area 264.9 Å 2
HOMO Energy -10.24 ± 0.55 eV
LUMO Energy 0.41 ± eV
Point Group Symmetry C1
Synonyms
  • 4-[[(2s)-2,4-dihydroxy-3,3-dimethyl-1-oxobutyl]amino]butanoic acid
  • 4-[[(2s)-2,4-dihydroxy-3,3-dimethyl-butanoyl]amino]butanoic acid
  • 4-[[(2s)-2,4-dihydroxy-3,3-dimethyl-butanoyl]amino]butyric acid
  • 4-[[(2s)-2,4-dihydroxy-3,3-dimethylbutanoyl]amino]butanoic acid
InChIKey SBBDHANTMHIRGW-MRVPVSSYSA-N
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