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Home > Boronic Acids > 1309978-63-9
1309978-63-9 | 2-Fluoro-6-(pyrrolidin-1-yl)pyridine-3-boronic acid pinacol ester
CAS No: 1309978-63-9 Catalog No: AG00HSBC MDL No:MFCD13563072
Product Description
Catalog Number:
AG00HSBC
Chemical Name:
2-Fluoro-6-(pyrrolidin-1-yl)pyridine-3-boronic acid pinacol ester
CAS Number:
1309978-63-9
Molecular Formula:
C15H22BFN2O2
Molecular Weight:
292.1568
MDL Number:
MFCD13563072
IUPAC Name:
2-fluoro-6-pyrrolidin-1-yl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C15H22BFN2O2/c1-14(2)15(3,4)21-16(20-14)11-7-8-12(18-13(11)17)19-9-5-6-10-19/h7-8H,5-6,9-10H2,1-4H3
InChI Key:
COKBPNNLEAKVLK-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(nc1F)N1CCCC1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.176g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.161g/mol
Monoisotopic Mass:
292.176g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
34.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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