Home Nitriles 3-Fluoro-5-methylbenzonitrile

3-Fluoro-5-methylbenzonitrile

CAS No.:
216976-30-6
Catalog Number:
AG003JGY
Molecular Formula:
C8H6FN
Molecular Weight:
135.1383
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>97%
In Stock USA
United States
$71
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Product Description
Catalog Number:
AG003JGY
Chemical Name:
3-Fluoro-5-methylbenzonitrile
CAS Number:
216976-30-6
Molecular Formula:
C8H6FN
Molecular Weight:
135.1383
MDL Number:
MFCD05662709
IUPAC Name:
3-fluoro-5-methylbenzonitrile
InChI:
InChI=1S/C8H6FN/c1-6-2-7(5-10)4-8(9)3-6/h2-4H,1H3
InChI Key:
GKUQCZSZQBEHCP-UHFFFAOYSA-N
SMILES:
N#Cc1cc(C)cc(c1)F
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.048g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.141g/mol
Monoisotopic Mass:
135.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties