Home Nitriles 1,3-Benzenedicarbonitrile, 2,5-difluoro-

1,3-Benzenedicarbonitrile, 2,5-difluoro-

CAS No.:
122546-74-1
Catalog Number:
AG0017FH
Molecular Formula:
C8H2F2N2
Molecular Weight:
164.1117
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Product Description
Catalog Number:
AG0017FH
Chemical Name:
1,3-Benzenedicarbonitrile, 2,5-difluoro-
CAS Number:
122546-74-1
Molecular Formula:
C8H2F2N2
Molecular Weight:
164.1117
MDL Number:
MFCD32011675
IUPAC Name:
2,5-difluorobenzene-1,3-dicarbonitrile
InChI:
InChI=1S/C8H2F2N2/c9-7-1-5(3-11)8(10)6(2-7)4-12/h1-2H
InChI Key:
MWGSTFSKJGWSGR-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)cc(c1F)C#N
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.019g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.115g/mol
Monoisotopic Mass:
164.019g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties