Home Halogens 2-(4-chloro-5-fluoro-3-methylpyridin-2-yl)-2-cyclopropylacetonitrile

2-(4-chloro-5-fluoro-3-methylpyridin-2-yl)-2-cyclopropylacetonitrile

CAS No.:
169749-86-4
Catalog Number:
AG01DKB8
Molecular Formula:
C11H10ClFN2
Molecular Weight:
224.6619
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Product Description
Catalog Number:
AG01DKB8
Chemical Name:
2-(4-chloro-5-fluoro-3-methylpyridin-2-yl)-2-cyclopropylacetonitrile
CAS Number:
169749-86-4
Molecular Formula:
C11H10ClFN2
Molecular Weight:
224.6619
MDL Number:
MFCD22371403
IUPAC Name:
2-(4-chloro-5-fluoro-3-methylpyridin-2-yl)-2-cyclopropylacetonitrile
InChI:
InChI=1S/C11H10ClFN2/c1-6-10(12)9(13)5-15-11(6)8(4-14)7-2-3-7/h5,7-8H,2-3H2,1H3
InChI Key:
KRNSFPJOYYLZBL-UHFFFAOYSA-N
SMILES:
N#CC(c1ncc(c(c1C)Cl)F)C1CC1
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.052g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.663g/mol
Monoisotopic Mass:
224.052g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties