
 2-chloro-1-(5-chlorothiophen-2-yl)ethanone

 14 14  0  0  0  0  0  0  0  0999 V2000
   -0.9493   -0.2319    0.0714 C   0  0  0  0  0
    0.0880    0.6895    0.0502 C   0  0  0  0  0
    1.6037   -0.1055   -0.0564 S   0  0  0  0  0
    0.8744   -1.6295   -0.0722 C   0  0  0  0  0
   -0.4919   -1.5811    0.0007 C   0  0  0  0  0
    1.8469   -3.0403   -0.1769 Cl  0  0  0  0  0
   -0.0514    2.1440    0.0980 C   0  0  0  0  0
   -1.1668    2.6755    0.1193 O   0  0  0  0  0
    1.1811    3.0260    0.1177 C   0  0  0  0  0
    1.8201    3.1186    1.7689 Cl  0  0  0  0  0
   -1.9931    0.0585    0.1356 H   0  0  0  0  0
   -1.1325   -2.4544    0.0031 H   0  0  0  0  0
    0.9016    4.0368   -0.1944 H   0  0  0  0  0
    1.9553    2.6724   -0.5668 H   0  0  0  0  0
  1  5  1  0  0  0
  1  2  2  0  0  0
  1 11  1  0  0  0
  2  3  1  0  0  0
  2  7  1  0  0  0
  3  4  1  0  0  0
  4  5  2  0  0  0
  4  6  1  0  0  0
  5 12  1  0  0  0
  7  9  1  0  0  0
  7  8  2  0  0  0
  9 10  1  0  0  0
  9 13  1  0  0  0
  9 14  1  0  0  0
M  END

>  <Chemical Name>
2-chloro-1-(5-chlorothiophen-2-yl)ethanone

>  <PubChem CID>
5101506

>  <Formula>
C6H4Cl2OS

>  <Molecular Weight>
195.057000

>  <IUPAC Name>
2-chloro-1-(5-chlorothiophen-2-yl)ethanone

>  <XlogP>
3.2

>  <Hydrogen Bond Donors>
0

>  <Hydrogen Bond Acceptors>
2

>  <Canonical SMILES>
C1=C(SC(=C1)Cl)C(=O)CCl

>  <Isomeric SMILES>
C1=C(SC(=C1)Cl)C(=O)CCl

>  <InChI Std. ID>
InChI=1S/C6H4Cl2OS/c7-3-4(9)5-1-2-6(8)10-5/h1-2H,3H2

>  <InChI Key>
JRHBEDSUTAGRQV-UHFFFAOYSA-N

