(3E)-4-[2-(1-Hydroxyhexyl)-4-Methylphenyl]-3-Butenoic Acid

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Properties Simple | Detailed

Formula C17H24O3
IUPAC Name (e)-4-[2-[(1s)-1-hydroxyhexyl]-4-methyl-phenyl]but-3-enoic acid
Molecular Mass 276.371 g·mol−1
Heat of Formation -622.8 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 366.9 Å 3
Surface Area 322.04 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 3.07 ± eV
Point Group Symmetry C1
InChIKey UPEPIFABRQWHTB-MOEXGYKKSA-N
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Elements H C O