1-(3-Chlorophenyl)-2,2,2-trifluoroethanol
  -molcms-06132601292D

 13 13  0  0  0  0  0  0  0  0999 V2000
   -3.4641    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
   -2.5981   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5981   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7321   -2.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -1.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7321    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -0.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -1.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.7321    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.7321   -1.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  7  2  1  0  0  0  0
  6  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 11  1  0  0  0  0
  9 12  1  0  0  0  0
  8 13  1  0  0  0  0
M  END
>  <ProductName>
1-(3-Chlorophenyl)-2,2,2-trifluoroethanol

>  <CASNumber>
81577-11-9

>  <MolecularFormula>
C8H6ClF3O

>  <MDLNo>
MFCD00461901

>  <MolWt>
210.58

>  <BoilingPoint>
238.8��40.0�� at 760 mmHg

>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
ClC1=CC=CC(=C1)C(C(F)(F)F)O

$$$$