5-Bromo-N-methyl-nicotinamide


Chemical Name: 5-Bromo-N-methyl-nicotinamide
CAS Number: 153435-68-8
Product Number: AG00AMDP(AGN-PC-03JN4C)
Synonyms:
MDL No: MFCD01788369
Molecular Formula: C7H7BrN2O
Molecular Weight: 215.0473

Identification/Properties


Computed Properties
Molecular Weight:
215.05g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
213.974g/mol
Monoisotopic Mass:
213.974g/mol
Topological Polar Surface Area:
42A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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