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Home > Boronic Acids > 864759-41-1
864759-41-1 | Benzamide,N-(6-methoxy-3-pyridinyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS No: 864759-41-1 Catalog No: AG004MPV MDL No:
Product Description
Catalog Number:
AG004MPV
Chemical Name:
Benzamide,N-(6-methoxy-3-pyridinyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-
CAS Number:
864759-41-1
Molecular Formula:
C19H23BN2O4
Molecular Weight:
354.2079
IUPAC Name:
N-(6-methoxypyridin-3-yl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
InChI:
InChI=1S/C19H23BN2O4/c1-18(2)19(3,4)26-20(25-18)14-8-6-13(7-9-14)17(23)22-15-10-11-16(24-5)21-12-15/h6-12H,1-5H3,(H,22,23)
InChI Key:
ZVFOHVFQBWYNIF-UHFFFAOYSA-N
SMILES:
COc1ccc(cn1)NC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
490
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.175g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
354.213g/mol
Monoisotopic Mass:
354.175g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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