Home Nitriles 4-Fluoroisophthalonitrile

4-Fluoroisophthalonitrile

CAS No.:
13519-90-9
Catalog Number:
AG007LIB
Molecular Formula:
C8H3FN2
Molecular Weight:
146.1212
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$93
- +
5g
98%
In Stock USA
United States
$413
- +
10g
98%
In Stock USA
United States
$725
- +
Product Description
Catalog Number:
AG007LIB
Chemical Name:
4-Fluoroisophthalonitrile
CAS Number:
13519-90-9
Molecular Formula:
C8H3FN2
Molecular Weight:
146.1212
MDL Number:
MFCD01657003
IUPAC Name:
4-fluorobenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8H3FN2/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3H
InChI Key:
FVEDLRVIWHFCBB-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)C#N)F
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.028g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.124g/mol
Monoisotopic Mass:
146.028g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties