Home Nitriles 4-Fluoro-2-nitrobenzonitrile

4-Fluoro-2-nitrobenzonitrile

CAS No.:
80517-21-1
Catalog Number:
AG003LDJ
Molecular Formula:
C7H3FN2O2
Molecular Weight:
166.1093
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$113
- +
10g
98%
In Stock USA
United States
$213
- +
25g
98%
In Stock USA
United States
$363
- +
Product Description
Catalog Number:
AG003LDJ
Chemical Name:
4-Fluoro-2-nitrobenzonitrile
CAS Number:
80517-21-1
Molecular Formula:
C7H3FN2O2
Molecular Weight:
166.1093
MDL Number:
MFCD00277447
IUPAC Name:
4-fluoro-2-nitrobenzonitrile
InChI:
InChI=1S/C7H3FN2O2/c8-6-2-1-5(4-9)7(3-6)10(11)12/h1-3H
InChI Key:
MNEAKKQYFSYZEU-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1[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:
1.4  
Properties