Home Nitriles 4-Chloro-3-fluorophenylacetonitrile

4-Chloro-3-fluorophenylacetonitrile

CAS No.:
251570-03-3
Catalog Number:
AG002QO4
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$32
- +
5g
97%
In Stock USA
United States
$75
- +
10g
97%
In Stock USA
United States
$125
- +
25g
97%
In Stock USA
United States
$263
- +
100g
97%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG002QO4
Chemical Name:
4-Chloro-3-fluorophenylacetonitrile
CAS Number:
251570-03-3
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
MDL Number:
MFCD04115860
IUPAC Name:
2-(4-chloro-3-fluorophenyl)acetonitrile
InChI:
InChI=1S/C8H5ClFN/c9-7-2-1-6(3-4-11)5-8(7)10/h1-2,5H,3H2
InChI Key:
IDBYHCGSWMSFLY-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(c(c1)F)Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.009g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.583g/mol
Monoisotopic Mass:
169.009g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties