-ISIS-  08091621332D

  9  9  0  0  0  0  0  0  0  0999 V2000
   -1.1958   -0.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8750    0.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1292    0.3625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3750   -1.1708    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4417   -0.5958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1375   -0.8958    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    1.3917   -0.8958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4583    1.1750    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.1333   -0.2250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  2  1  0  0  0  0
  4  1  1  0  0  0  0
  5  4  1  0  0  0  0
  6  1  1  0  0  0  0
  7  5  1  0  0  0  0
  8  2  1  0  0  0  0
  9  7  2  0  0  0  0
  5  3  2  0  0  0  0
M  END
>  <ID> (BBL000034)
BBL000034

>  <Rotatable_Bonds> (BBL000034)
1

>  <logP> (BBL000034)
2.545

>  <PSA> (BBL000034)
30.21

>  <H_Donors> (BBL000034)
0

>  <H_Acceptors> (BBL000034)
2

>  <Number_of_rings> (BBL000034)
1

>  <NAME> (BBL000034)
4,5-dibromofuran-2-carbaldehyde

>  <Mol_Weight> (BBL000034)
253.88

>  <Mol_Formula> (BBL000034)
C5H2Br2O2

>  <Smiles> (BBL000034)
O=Cc1oc(c(c1)Br)Br

>  <CAS_Number> (BBL000034)
2433-85-4

>  <Alternative_identifier> (BBL000034)
MFCD00658947

$$$$