D-Allo-Isoleucine

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Properties Simple | Detailed

Formula C6H13NO2
IUPAC Name (2r,3s)-2-amino-3-methyl-pentanoic acid
Molecular Mass 131.173 g·mol−1
Heat of Formation -474.1 ± 16.7 kJ·mol−1
Dipole Moment 1.29 ± 1.08 D
Volume 175.71 Å 3
Surface Area 172.46 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy 0.43 ± eV
Point Group Symmetry C1
Synonyms
  • (2r, 3s)-2-amino-3-methylpentanoic acid
  • (2r,3s)-2-amino-3-methyl-pentanoic acid
  • (2r,3s)-2-amino-3-methyl-valeric acid
  • (2r,3s)-2-amino-3-methylpentanoic acid
  • (2rs,3sr)-2-amino-3-methylpentanoic acid
  • (r)-2-amino-(s)-3-methylvaleric acid
  • d-alloisoleucine
  • d-isoleucine
  • threo-d-isoleucine
CAS Number(s)
  • 1509-35-9
  • 443-79-8
InChIKey AGPKZVBTJJNPAG-CRCLSJGQSA-N
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