Home Halogens 2-(6-chloro-3-methoxypyridin-2-yl)acetonitrile

2-(6-chloro-3-methoxypyridin-2-yl)acetonitrile

CAS No.:
1261812-28-5
Catalog Number:
AG01A4NX
Molecular Formula:
C8H7ClN2O
Molecular Weight:
182.6070
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Product Description
Catalog Number:
AG01A4NX
Chemical Name:
2-(6-chloro-3-methoxypyridin-2-yl)acetonitrile
CAS Number:
1261812-28-5
Molecular Formula:
C8H7ClN2O
Molecular Weight:
182.6070
MDL Number:
MFCD18415772
IUPAC Name:
2-(6-chloro-3-methoxypyridin-2-yl)acetonitrile
InChI:
InChI=1S/C8H7ClN2O/c1-12-7-2-3-8(9)11-6(7)4-5-10/h2-3H,4H2,1H3
InChI Key:
USWFOQPAIRSGAF-UHFFFAOYSA-N
SMILES:
COc1ccc(nc1CC#N)Cl
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.025g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.607g/mol
Monoisotopic Mass:
182.025g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties