Home Nitriles 3,4-Difluoro-5-nitrobenzonitrile

3,4-Difluoro-5-nitrobenzonitrile

CAS No.:
1119454-07-7
Catalog Number:
AG008ULF
Molecular Formula:
C7H2F2N2O2
Molecular Weight:
184.0998
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
1 week
United States
$60
- +
250mg
95%
1 week
United States
$91
- +
1g
95%
1 week
United States
$206
- +
Product Description
Catalog Number:
AG008ULF
Chemical Name:
3,4-Difluoro-5-nitrobenzonitrile
CAS Number:
1119454-07-7
Molecular Formula:
C7H2F2N2O2
Molecular Weight:
184.0998
MDL Number:
MFCD11110377
IUPAC Name:
3,4-difluoro-5-nitrobenzonitrile
InChI:
InChI=1S/C7H2F2N2O2/c8-5-1-4(3-10)2-6(7(5)9)11(12)13/h1-2H
InChI Key:
KMDZJXUOUOWZAK-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)c(c(c1)[N+](=O)[O-])F
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