Home Nitriles 2-Fluoro-5-methylphenylacetonitrile

2-Fluoro-5-methylphenylacetonitrile

CAS No.:
945541-97-9
Catalog Number:
AG00IIBZ
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
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Product Description
Catalog Number:
AG00IIBZ
Chemical Name:
2-Fluoro-5-methylphenylacetonitrile
CAS Number:
945541-97-9
Molecular Formula:
C9H8FN
Molecular Weight:
149.1649
MDL Number:
MFCD07772783
IUPAC Name:
2-(2-fluoro-5-methylphenyl)acetonitrile
InChI:
InChI=1S/C9H8FN/c1-7-2-3-9(10)8(6-7)4-5-11/h2-3,6H,4H2,1H3
InChI Key:
OYOGNBWWSNXFQI-UHFFFAOYSA-N
SMILES:
Cc1cc(CC#N)c(cc1)F
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.064g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.168g/mol
Monoisotopic Mass:
149.064g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties