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Home > Boronic Acids > 1349151-98-9
1349151-98-9 | 1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester
CAS No: 1349151-98-9 Catalog No: AG009VVW MDL No:MFCD16995643
Product Description
Catalog Number:
AG009VVW
Chemical Name:
1-Isopropyl-6-oxo-1,6-dihydropyridine-3-boronic Acid Pinacol Ester
CAS Number:
1349151-98-9
Molecular Formula:
C14H22BNO3
Molecular Weight:
263.1404
MDL Number:
MFCD16995643
IUPAC Name:
1-propan-2-yl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one
InChI:
InChI=1S/C14H22BNO3/c1-10(2)16-9-11(7-8-12(16)17)15-18-13(3,4)14(5,6)19-15/h7-10H,1-6H3
InChI Key:
MPMZBWLBVFEODR-UHFFFAOYSA-N
SMILES:
CC(n1cc(ccc1=O)B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
436
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.169g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.144g/mol
Monoisotopic Mass:
263.169g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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