Home Nitriles 4-Fluoro-3-nitrobenzonitrile

4-Fluoro-3-nitrobenzonitrile

CAS No.:
1009-35-4
Catalog Number:
AG00034S
Molecular Formula:
C7H3FN2O2
Molecular Weight:
166.1093
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$23
- +
25g
98%
In Stock USA
United States
$69
- +
100g
98%
In Stock USA
United States
$188
- +
500g
98%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00034S
Chemical Name:
4-Fluoro-3-nitrobenzonitrile
CAS Number:
1009-35-4
Molecular Formula:
C7H3FN2O2
Molecular Weight:
166.1093
MDL Number:
MFCD01632197
IUPAC Name:
4-fluoro-3-nitrobenzonitrile
InChI:
InChI=1S/C7H3FN2O2/c8-6-2-1-5(4-9)3-7(6)10(11)12/h1-3H
InChI Key:
LKOWKPGBAZVHOF-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)[N+](=O)[O-])F
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.018g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.111g/mol
Monoisotopic Mass:
166.018g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Literature
Title Journal
Palladium(0)-catalyzed amination, Stille coupling, and Suzuki coupling of electron-deficient aryl fluorides. Journal of the American Chemical Society 20030219
Properties