2-Isocyanato-1-methoxy-4-(trifluoromethoxy)benzene
  -molcms-05192605032D

 16 16  0  0  0  0  0  0  0  0999 V2000
    0.0000    1.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    1.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660    2.5000    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
   -1.7321    1.0000    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
   -2.5981   -0.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4641    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4641    1.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3301   -0.5000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3301    0.5000    0.0000 F   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
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8660   -0.5000    0.0000 N   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   -2.5000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  1  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
  8 11  1  0  0  0  0
  6 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13  1  1  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  2  0  0  0  0
M  END
>  <ProductName>
2-Isocyanato-1-methoxy-4-(trifluoromethoxy)benzene

>  <CASNumber>
1261587-55-6

>  <MolecularFormula>
C9H6F3NO3

>  <MDLNo>


>  <MolWt>
233.14

>  <BoilingPoint>
253.0��40.0 ��C(Predicted)

>  <MeltingPoint>


>  <MolFile>


>  <Smiles>
C1(OC)=CC=C(OC(F)(F)F)C=C1N=C=O

$$$$