Home Halogens 6-bromo-5-methoxypyridine-2-carbonitrile

6-bromo-5-methoxypyridine-2-carbonitrile

CAS No.:
1112851-37-2
Catalog Number:
AG00HC4Q
Molecular Formula:
C7H5BrN2O
Molecular Weight:
213.0314
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Product Description
Catalog Number:
AG00HC4Q
Chemical Name:
6-bromo-5-methoxypyridine-2-carbonitrile
CAS Number:
1112851-37-2
Molecular Formula:
C7H5BrN2O
Molecular Weight:
213.0314
MDL Number:
MFCD20039958
IUPAC Name:
6-bromo-5-methoxypyridine-2-carbonitrile
InChI:
InChI=1S/C7H5BrN2O/c1-11-6-3-2-5(4-9)10-7(6)8/h2-3H,1H3
InChI Key:
VDEZFORNGSDBIW-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(n1)Br)OC
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.959g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.034g/mol
Monoisotopic Mass:
211.959g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties