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1361941-27-6 | 1-Methyl-3-nitro-5-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-1H-pyridin-2-one
CAS No: 1361941-27-6 Catalog No: AG009W7K MDL No:
Product Description
Catalog Number:
AG009W7K
Chemical Name:
1-Methyl-3-nitro-5-(4,4,5,5-tetraMethyl-[1,3,2]dioxaborolan-2-yl)-1H-pyridin-2-one
CAS Number:
1361941-27-6
IUPAC Name:
1-methyl-3-nitro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-one
InChI:
InChI=1S/C12H17BN2O5/c1-11(2)12(3,4)20-13(19-11)8-6-9(15(17)18)10(16)14(5)7-8/h6-7H,1-5H3
InChI Key:
NLGFSHQZQGTGGY-UHFFFAOYSA-N
Properties
Complexity:
517
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.123g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.087g/mol
Monoisotopic Mass:
280.123g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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