Home Nitriles 5-Fluoro-2-nitrobenzonitrile

5-Fluoro-2-nitrobenzonitrile

CAS No.:
50594-78-0
Catalog Number:
AG00I934
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
$42
- +
10g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$150
- +
100g
98%
In Stock USA
United States
$388
- +
Product Description
Catalog Number:
AG00I934
Chemical Name:
5-Fluoro-2-nitrobenzonitrile
CAS Number:
50594-78-0
Molecular Formula:
C7H3FN2O2
Molecular Weight:
166.1093
MDL Number:
MFCD01632196
IUPAC Name:
5-fluoro-2-nitrobenzonitrile
InChI:
InChI=1S/C7H3FN2O2/c8-6-1-2-7(10(11)12)5(3-6)4-9/h1-3H
InChI Key:
VCEQYKYTIDJWTD-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)ccc1[N+](=O)[O-]
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:
1.4  
Properties