7-(2,2-Dimethyl-4-Phenyl-1,3-Dioxan-5-Yl)Heptenoic Acid

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Properties Simple | Detailed

Formula C19H26O4
IUPAC Name (e)-7-[(4s,5s)-2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl]hept-2-enoic acid
Molecular Mass 318.407 g·mol−1
Heat of Formation -737.6 ± 16.7 kJ·mol−1
Dipole Moment 1.45 ± 1.08 D
Volume 410.69 Å 3
Surface Area 369.0 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy -0.30 ± eV
Point Group Symmetry C1
InChIKey QOOUFKCOPRWLLB-GNOWRCIYSA-N
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