(2S,3R,4S)-2-Amino-1-Cyclohexyl-6-Methyl-3,4-Heptanediol

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Formula C14H29NO2
IUPAC Name (2s,3r,4s)-2-amino-1-cyclohexyl-6-methyl-heptane-3,4-diol
Molecular Mass 243.386 g·mol−1
Heat of Formation -627.6 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 341.83 Å 3
Surface Area 302.58 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 2.30 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s)-2-amino-1-cyclohexyl-6-methyl-heptane-3,4-diol
  • (2s,3r,4s)-2-amino-1-cyclohexyl-6-methylheptane-3,4-diol
  • 1-cyclohexyl-2-amino-3,4-dihydroxy-6-methylheptane
  • gcl
InChIKey KGYZGGUJJIVOQX-MELADBBJSA-N
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