1,3-Dideoxy-4-C-Methyl-D-Erythro-Pentitol

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Properties Simple | Detailed

Formula C6H14O3
IUPAC Name (2s,4s)-2-methylpentane-1,2,4-triol
Molecular Mass 134.174 g·mol−1
Heat of Formation -696.1 ± 16.7 kJ·mol−1
Dipole Moment 4.02 ± 1.08 D
Volume 176.52 Å 3
Surface Area 173.24 Å 2
HOMO Energy -10.05 ± 0.55 eV
LUMO Energy 5.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,4s)-2-methylpentane-1,2,4-triol
  • 2-methylpentane-1,2,4-triol
InChIKey OMXLSJPESIOAGG-WDSKDSINSA-N
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Elements H C O