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Home > Boronic Acids > 1610521-45-3
1610521-45-3 | N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)picolinamide
CAS No: 1610521-45-3 Catalog No: AG01DUCU MDL No:
Product Description
Catalog Number:
AG01DUCU
Chemical Name:
N-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)picolinamide
CAS Number:
1610521-45-3
Molecular Formula:
C18H21BN2O3
Molecular Weight:
324.1819
IUPAC Name:
N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]pyridine-2-carboxamide
InChI:
InChI=1S/C18H21BN2O3/c1-17(2)18(3,4)24-19(23-17)13-8-7-9-14(12-13)21-16(22)15-10-5-6-11-20-15/h5-12H,1-4H3,(H,21,22)
InChI Key:
CJULCRUIZBGNCX-UHFFFAOYSA-N
SMILES:
O=C(c1ccccn1)Nc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
453
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
324.165g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
324.187g/mol
Monoisotopic Mass:
324.165g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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