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Home > Boronic Acids > 501944-65-6
501944-65-6 | 6-FLUOROBENZO[B]THIENE-2-BORONIC ACID
CAS No: 501944-65-6 Catalog No: AG00DFT2 MDL No:MFCD09952067
Product Description
Catalog Number:
AG00DFT2
Chemical Name:
6-FLUOROBENZO[B]THIENE-2-BORONIC ACID
CAS Number:
501944-65-6
Molecular Formula:
C8H6BFO2S
Molecular Weight:
196.0064
MDL Number:
MFCD09952067
IUPAC Name:
(6-fluoro-1-benzothiophen-2-yl)boronic acid
InChI:
InChI=1S/C8H6BFO2S/c10-6-2-1-5-3-8(9(11)12)13-7(5)4-6/h1-4,11-12H
InChI Key:
SVGUNYFQHHUNDJ-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1)sc(c2)B(O)O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.017g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.002g/mol
Monoisotopic Mass:
196.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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