1,7-Heptanediol

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Properties Simple | Detailed

Formula C7H16O2
IUPAC Name heptane-1,7-diol
Molecular Mass 132.201 g·mol−1
Heat of Formation -505.1 ± 16.7 kJ·mol−1
Dipole Moment 2.52 ± 1.08 D
Volume 191.71 Å 3
Surface Area 198.9 Å 2
HOMO Energy -10.61 ± 0.55 eV
LUMO Energy 2.76 ± eV
Point Group Symmetry C1
Synonyms
  • .alpha.,.omega.-heptanediol
  • 1,7-dihydroxyheptane
  • 1,7-heptane-diol
  • alpha,omega-heptanediol
  • heptamethylene glycol
CAS Number(s)
  • 629-30-1
InChIKey SXCBDZAEHILGLM-UHFFFAOYSA-N
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