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Home > Boronic Acids > 1309982-23-7
1309982-23-7 | 6-Bromo-4-methylpyridine-3-boronic acid pinacol ester
CAS No: 1309982-23-7 Catalog No: AG009XU7 MDL No:MFCD12198139
Product Description
Catalog Number:
AG009XU7
Chemical Name:
6-Bromo-4-methylpyridine-3-boronic acid pinacol ester
CAS Number:
1309982-23-7
Molecular Formula:
C12H17BBrNO2
Molecular Weight:
297.9839
MDL Number:
MFCD12198139
IUPAC Name:
2-bromo-4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C12H17BBrNO2/c1-8-6-10(14)15-7-9(8)13-16-11(2,3)12(4,5)17-13/h6-7H,1-5H3
InChI Key:
GJGGRCOYIOORTC-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1cnc(cc1C)Br
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.054g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.987g/mol
Monoisotopic Mass:
297.054g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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