Home Nitriles Benzonitrile, 2-fluoro-6-(methylamino)-

Benzonitrile, 2-fluoro-6-(methylamino)-

CAS No.:
96783-85-6
Catalog Number:
AG00IJUX
Molecular Formula:
C8H7FN2
Molecular Weight:
150.1530
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Product Description
Catalog Number:
AG00IJUX
Chemical Name:
Benzonitrile, 2-fluoro-6-(methylamino)-
CAS Number:
96783-85-6
Molecular Formula:
C8H7FN2
Molecular Weight:
150.1530
MDL Number:
MFCD12193344
IUPAC Name:
2-fluoro-6-(methylamino)benzonitrile
InChI:
InChI=1S/C8H7FN2/c1-11-8-4-2-3-7(9)6(8)5-10/h2-4,11H,1H3
InChI Key:
HORADRWTTKWYNT-UHFFFAOYSA-N
SMILES:
CNc1cccc(c1C#N)F
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
150.156g/mol
Monoisotopic Mass:
150.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties