3-[3-(3,5-Dimethyl-1H-Pyrazol-4-Yl)Propoxy]-4-Fluorobenzoic Acid

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Properties Simple | Detailed

Formula C15H17FN2O3
IUPAC Name 3-[3-(3,5-dimethylpyrazol-1-ium-4-id-4-yl)propoxy]-4-fluoro-benzoic acid
Molecular Mass 292.305 g·mol−1
Heat of Formation -554.8 ± 16.7 kJ·mol−1
Dipole Moment 2.50 ± 1.08 D
Volume 344.76 Å 3
Surface Area 323.14 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy 2.07 ± eV
Point Group Symmetry C1
InChIKey WBFUHHBPNXWNCC-UHFFFAOYSA-N
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