Home Nitriles 2,5-Difluoro-4-nitrobenzonitrile

2,5-Difluoro-4-nitrobenzonitrile

CAS No.:
172921-32-3
Catalog Number:
AG00AE9P
Molecular Formula:
C7H2F2N2O2
Molecular Weight:
184.0998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00AE9P
Chemical Name:
2,5-Difluoro-4-nitrobenzonitrile
CAS Number:
172921-32-3
Molecular Formula:
C7H2F2N2O2
Molecular Weight:
184.0998
MDL Number:
MFCD13185567
IUPAC Name:
2,5-difluoro-4-nitrobenzonitrile
InChI:
InChI=1S/C7H2F2N2O2/c8-5-2-7(11(12)13)6(9)1-4(5)3-10/h1-2H
InChI Key:
HKKHVLVXHJDVQE-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(cc1F)[N+](=O)[O-]
Properties
Complexity:
257  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.008g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.102g/mol
Monoisotopic Mass:
184.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties