2,3,5,6-Tetrafluoro-4-Methylbenzyl (1R,3R)-2,2-Dimethyl-3-[(1E)-1-Propen-1-Yl]Cyclopropanecarboxylate

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Formula C17H18F4O2
IUPAC Name (2,3,5,6-tetrafluoro-4-methyl-phenyl)methyl (1r,3r)-2,2-dimethyl-3-[(e)-prop-1-enyl]cyclopropanecarboxylate
Molecular Mass 330.317 g·mol−1
Heat of Formation -1000.4 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 379.93 Å 3
Surface Area 339.94 Å 2
HOMO Energy -9.68 ± 0.55 eV
LUMO Energy 1.96 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,3r)-2,2-dimethyl-3-[(e)-prop-1-enyl]-1-cyclopropanecarboxylic acid (2,3,5,6-tetrafluoro-4-methylphenyl)methyl ester
  • (1r,3r)-2,2-dimethyl-3-[(e)-prop-1-enyl]cyclopropane-1-carboxylic acid (2,3,5,6-tetrafluoro-4-methyl-benzyl) ester
  • (2,3,5,6-tetrafluoro-4-methyl-phenyl)methyl (1r,3r)-2,2-dimethyl-3-[(e)-prop-1-enyl]cyclopropane-1-carboxylate
  • (2,3,5,6-tetrafluoro-4-methylphenyl)methyl (1r,3r)-2,2-dimethyl-3-[(e)-prop-1-enyl]cyclopropane-1-carboxylate
InChIKey AGMMRUPNXPWLGF-PVTPVBHGSA-N
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