2(1H)-Pyridinone, 3-bromo-1-methyl-


Chemical Name: 2(1H)-Pyridinone, 3-bromo-1-methyl-
CAS Number: 81971-38-2
Product Number: AG003A59(AGN-PC-00KILL)
Synonyms:
MDL No:
Molecular Formula: C6H6BrNO
Molecular Weight: 188.0219

Identification/Properties


Computed Properties
Molecular Weight:
188.024g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
186.963g/mol
Monoisotopic Mass:
186.963g/mol
Topological Polar Surface Area:
20.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
195
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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