Home Nitriles 2-Chloro-5-Methoxynicotinonitrile

2-Chloro-5-Methoxynicotinonitrile

CAS No.:
74650-73-0
Catalog Number:
AG00FX07
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
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Product Description
Catalog Number:
AG00FX07
Chemical Name:
2-Chloro-5-Methoxynicotinonitrile
CAS Number:
74650-73-0
Molecular Formula:
C7H5ClN2O
Molecular Weight:
168.5804
MDL Number:
MFCD18255084
IUPAC Name:
2-chloro-5-methoxypyridine-3-carbonitrile
InChI:
InChI=1S/C7H5ClN2O/c1-11-6-2-5(3-9)7(8)10-4-6/h2,4H,1H3
InChI Key:
MAXCZWUUQRMEGU-UHFFFAOYSA-N
SMILES:
COc1cnc(c(c1)C#N)Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.58g/mol
Monoisotopic Mass:
168.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties