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Home > Boronic Acids > 1416853-79-6
1416853-79-6 | (4-fluoro-1-benzothiophen-2-yl)boronic acid
CAS No: 1416853-79-6 Catalog No: AG01EL2P MDL No:MFCD28673710
Product Description
Catalog Number:
AG01EL2P
Chemical Name:
(4-fluoro-1-benzothiophen-2-yl)boronic acid
CAS Number:
1416853-79-6
Molecular Formula:
C8H6BFO2S
Molecular Weight:
196.0064
MDL Number:
MFCD28673710
IUPAC Name:
(4-fluoro-1-benzothiophen-2-yl)boronic acid
InChI:
InChI=1S/C8H6BFO2S/c10-6-2-1-3-7-5(6)4-8(13-7)9(11)12/h1-4,11-12H
InChI Key:
VFHIMNGLYVVYPU-UHFFFAOYSA-N
SMILES:
OB(c1sc2c(c1)c(F)ccc2)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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