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Home > Boronic Acids > 1310384-31-6
1310384-31-6 | 5-Fluoro-6-benzoxypyridine-3-boronic acid
CAS No: 1310384-31-6 Catalog No: AG009XU2 MDL No:MFCD07374962
Product Description
Catalog Number:
AG009XU2
Chemical Name:
5-Fluoro-6-benzoxypyridine-3-boronic acid
CAS Number:
1310384-31-6
Molecular Formula:
C12H11BFNO3
Molecular Weight:
247.0300
MDL Number:
MFCD07374962
IUPAC Name:
(5-fluoro-6-phenylmethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H11BFNO3/c14-11-6-10(13(16)17)7-15-12(11)18-8-9-4-2-1-3-5-9/h1-7,16-17H,8H2
InChI Key:
JCUQHFDLLBAQKN-UHFFFAOYSA-N
SMILES:
Fc1cc(cnc1OCc1ccccc1)B(O)O
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.082g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
247.032g/mol
Monoisotopic Mass:
247.082g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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