(2S,5S)-2,5-Hexanediol

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Properties Simple | Detailed

Formula C6H14O2
IUPAC Name (2s,5s)-hexane-2,5-diol
Molecular Mass 118.174 g·mol−1
Heat of Formation -520.5 ± 16.7 kJ·mol−1
Dipole Moment 2.72 ± 1.08 D
Volume 168.23 Å 3
Surface Area 171.73 Å 2
HOMO Energy -10.41 ± 0.55 eV
LUMO Energy 5.92 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 34338-96-0
InChIKey OHMBHFSEKCCCBW-WDSKDSINSA-N
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