5-bromo-3-methoxypyridine-2-carbonitrile


Chemical Name: 5-bromo-3-methoxypyridine-2-carbonitrile
CAS Number: 36057-46-2
Product Number: AG00C756(AGN-PC-078TBU)
Synonyms:
MDL No:
Molecular Formula: C7H5BrN2O
Molecular Weight: 213.0314

Identification/Properties


Computed Properties
Molecular Weight:
213.034g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
211.959g/mol
Monoisotopic Mass:
211.959g/mol
Topological Polar Surface Area:
45.9A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
177
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


NMR Spectrum


Other Analytical Data


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