2-Benzyl-5,5,5-Trifluoro-4-Oxopentanoic Acid

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Properties Simple | Detailed

Formula C12H11F3O3
IUPAC Name (2s)-2-benzyl-5,5,5-trifluoro-4-oxo-pentanoic acid
Molecular Mass 260.209 g·mol−1
Heat of Formation -1132.7 ± 16.7 kJ·mol−1
Dipole Moment 1.97 ± 1.08 D
Volume 285.71 Å 3
Surface Area 258.83 Å 2
HOMO Energy -9.80 ± 0.55 eV
LUMO Energy -0.81 ± eV
Point Group Symmetry C1
InChIKey YFBZRNCKPGDTBO-VIFPVBQESA-N
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