1,2:4,5-Dianhydro-1-(7-Carboxylatoheptyl)-3-Deoxy-5-Pentylpentitol

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Properties Simple | Detailed

Formula C18H32O4
IUPAC Name 8-[(2s,3s)-3-[[(2s,3s)-3-pentyloxiran-2-yl]methyl]oxiran-2-yl]octanoic acid
Molecular Mass 312.444 g·mol−1
Heat of Formation -795.1 ± 16.7 kJ·mol−1
Dipole Moment 1.91 ± 1.08 D
Volume 433.24 Å 3
Surface Area 345.33 Å 2
HOMO Energy -10.44 ± 0.55 eV
LUMO Energy 0.79 ± eV
Point Group Symmetry C1
InChIKey LAIUZQCFIABNDP-QAETUUGQSA-N
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