Home Nitriles 2-(5-Bromo-3-fluoro-2-nitrophenyl)acetonitrile

2-(5-Bromo-3-fluoro-2-nitrophenyl)acetonitrile

CAS No.:
1807211-69-3
Catalog Number:
AG00I06O
Molecular Formula:
C8H4BrFN2O2
Molecular Weight:
259.0320
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$188
- +
1g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG00I06O
Chemical Name:
2-(5-Bromo-3-fluoro-2-nitrophenyl)acetonitrile
CAS Number:
1807211-69-3
Molecular Formula:
C8H4BrFN2O2
Molecular Weight:
259.0320
MDL Number:
MFCD27981294
IUPAC Name:
2-(5-bromo-3-fluoro-2-nitrophenyl)acetonitrile
InChI:
InChI=1S/C8H4BrFN2O2/c9-6-3-5(1-2-11)8(12(13)14)7(10)4-6/h3-4H,1H2
InChI Key:
VLKWBFAPZRQLNG-UHFFFAOYSA-N
SMILES:
N#CCc1cc(Br)cc(c1[N+](=O)[O-])F
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.944g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.034g/mol
Monoisotopic Mass:
257.944g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties