
 Thiophene-2-boronic acid

 13 13  0  0  0  0  0  0  0  0999 V2000
    1.1071    0.2527   -0.0555 B   0  0  0  0  0
    0.2949   -1.0822    0.0021 C   0  0  0  0  0
    0.7901   -2.3744   -0.1905 C   0  0  0  0  0
   -0.2084   -3.3810   -0.0723 C   0  0  0  0  0
   -1.4806   -2.8758    0.2124 C   0  0  0  0  0
   -1.3273   -1.2272    0.3061 S   0  0  0  0  0
    2.5406    0.2266   -0.3361 O   0  0  0  0  0
    0.4342    1.5295    0.1712 O   0  0  0  0  0
    1.8276   -2.5928   -0.4082 H   0  0  0  0  0
   -0.0030   -4.4363   -0.1910 H   0  0  0  0  0
   -2.3862   -3.4521    0.3449 H   0  0  0  0  0
    2.9694    0.1554    0.5540 H   0  0  0  0  0
    0.1424    1.8228   -0.7288 H   0  0  0  0  0
  1  8  1  0  0  0
  1  7  1  0  0  0
  1  2  1  0  0  0
  2  3  2  0  0  0
  2  6  1  0  0  0
  3  4  1  0  0  0
  3  9  1  0  0  0
  4  5  2  0  0  0
  4 10  1  0  0  0
  5  6  1  0  0  0
  5 11  1  0  0  0
  7 12  1  0  0  0
  8 13  1  0  0  0
M  END

>  <Chemical Name>
Thiophene-2-boronic acid

>  <PubChem CID>
2733960

>  <Formula>
C4H5BO2S

>  <Molecular Weight>
127.952000

>  <IUPAC Name>
thiophen-2-ylboronic acid

>  <XlogP>
-10000

>  <Hydrogen Bond Donors>
2

>  <Hydrogen Bond Acceptors>
3

>  <Canonical SMILES>
B(C1=CC=CS1)(O)O

>  <Isomeric SMILES>
B(C1=CC=CS1)(O)O

>  <InChI Std. ID>
InChI=1S/C4H5BO2S/c6-5(7)4-2-1-3-8-4/h1-3,6-7H

>  <InChI Key>
ARYHTUPFQTUBBG-UHFFFAOYSA-N

