2-(Trifluoromethyl)Phenol

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Properties Simple | Detailed

Formula C7H5F3O
IUPAC Name 2-(trifluoromethyl)phenol
Molecular Mass 162.109 g·mol−1
Heat of Formation -765.6 ± 16.7 kJ·mol−1
Dipole Moment 4.51 ± 1.08 D
Volume 162.92 Å 3
Surface Area 164.75 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy -0.74 ± eV
Point Group Symmetry Cs
Synonyms
  • 2-hydroxybenzotrifluoride
  • 2-trifluoromethylphenol
  • alpha,alpha,alpha-trifluoro-o-cresol
  • jrd-0001
  • o-(trifluoromethoxy)phenol
  • o-cresol, .alpha.,.alpha.,.alpha.-trifluoro-
  • o-hydroxybenzotrifluoride
  • phenol, 2-(trifluoromethyl)-
CAS Number(s)
  • 444-30-4
InChIKey ZOQOPXVJANRGJZ-UHFFFAOYSA-N
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