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Home Nitriles Tetrafluoroisophthalonitrile

Tetrafluoroisophthalonitrile

CAS No.:
2377-81-3
Catalog Number:
AG003FLF
Molecular Formula:
C8F4N2
Molecular Weight:
200.0926
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$49
- +
5g
95%
In Stock USA
United States
$200
- +
25g
95%
In Stock USA
United States
$763
- +
Product Description
Catalog Number:
AG003FLF
Chemical Name:
Tetrafluoroisophthalonitrile
CAS Number:
2377-81-3
Molecular Formula:
C8F4N2
Molecular Weight:
200.0926
MDL Number:
MFCD00013290
IUPAC Name:
2,4,5,6-tetrafluorobenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8F4N2/c9-5-3(1-13)6(10)8(12)7(11)4(5)2-14
InChI Key:
WVHMPQKZPHOCRD-UHFFFAOYSA-N
SMILES:
N#Cc1c(F)c(C#N)c(c(c1F)F)F
Properties
Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.096g/mol
Monoisotopic Mass:
200g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Literature
Title Journal
Synthesis and antimicrobial activity of polyhalo isophthalonitrile derivatives. Bioorganic & medicinal chemistry letters 20130415
Properties