Home Nitriles 4-Pyridinecarbonitrile, 3-(2-fluorophenyl)-

4-Pyridinecarbonitrile, 3-(2-fluorophenyl)-

CAS No.:
868944-77-8
Catalog Number:
AG004I62
Molecular Formula:
C12H7FN2
Molecular Weight:
198.1958
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Product Description
Catalog Number:
AG004I62
Chemical Name:
4-Pyridinecarbonitrile, 3-(2-fluorophenyl)-
CAS Number:
868944-77-8
Molecular Formula:
C12H7FN2
Molecular Weight:
198.1958
MDL Number:
MFCD14698979
IUPAC Name:
3-(2-fluorophenyl)pyridine-4-carbonitrile
InChI:
InChI=1S/C12H7FN2/c13-12-4-2-1-3-10(12)11-8-15-6-5-9(11)7-14/h1-6,8H
InChI Key:
XOFNFANGRPSNFB-UHFFFAOYSA-N
SMILES:
N#Cc1ccncc1c1ccccc1F
Properties
Complexity:
258  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.059g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.2g/mol
Monoisotopic Mass:
198.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties