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Home > Boronic Acids > 1253575-68-6

1253575-68-6

1253575-68-6 | 5-(Benzyloxy)-2-fluoropyridin-3-ylboronic acid

CAS No: 1253575-68-6 Catalog No: AG00HI6K MDL No:MFCD18255079

Product Description

Catalog Number:
AG00HI6K
Chemical Name:
5-(Benzyloxy)-2-fluoropyridin-3-ylboronic acid
CAS Number:
1253575-68-6
Molecular Formula:
C12H11BFNO3
Molecular Weight:
247.0300
MDL Number:
MFCD18255079
IUPAC Name:
(2-fluoro-5-phenylmethoxypyridin-3-yl)boronic acid
InChI:
InChI=1S/C12H11BFNO3/c14-12-11(13(16)17)6-10(7-15-12)18-8-9-4-2-1-3-5-9/h1-7,16-17H,8H2
InChI Key:
VGGIPGPRFUGWIQ-UHFFFAOYSA-N
SMILES:
OB(c1cc(OCc2ccccc2)cnc1F)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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