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Home > Boronic Acids > 1310383-24-4
1310383-24-4 | 5-Methyl-2-(pivalamido)pyridine-3-boronic acid pinacol ester
CAS No: 1310383-24-4 Catalog No: AG00HSC1 MDL No:MFCD13563040
Product Description
Catalog Number:
AG00HSC1
Chemical Name:
5-Methyl-2-(pivalamido)pyridine-3-boronic acid pinacol ester
CAS Number:
1310383-24-4
Molecular Formula:
C17H27BN2O3
Molecular Weight:
318.2189
MDL Number:
MFCD13563040
IUPAC Name:
2,2-dimethyl-N-[5-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]propanamide
InChI:
InChI=1S/C17H27BN2O3/c1-11-9-12(18-22-16(5,6)17(7,8)23-18)13(19-10-11)20-14(21)15(2,3)4/h9-10H,1-8H3,(H,19,20,21)
InChI Key:
PBTBPBSYLWBMPY-UHFFFAOYSA-N
SMILES:
Cc1cnc(c(c1)B1OC(C(O1)(C)C)(C)C)NC(=O)C(C)(C)C
Properties
Complexity:
443
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.211g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.224g/mol
Monoisotopic Mass:
318.211g/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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