Home Nitriles 3-Chloro-2-fluorophenylacetonitrile

3-Chloro-2-fluorophenylacetonitrile

CAS No.:
261762-98-5
Catalog Number:
AG002S1U
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$39
- +
1g
95%
In Stock USA
United States
$57
- +
5g
95%
In Stock USA
United States
$183
- +
10g
95%
In Stock USA
United States
$343
- +
25g
95%
In Stock USA
United States
$741
- +
Product Description
Catalog Number:
AG002S1U
Chemical Name:
3-Chloro-2-fluorophenylacetonitrile
CAS Number:
261762-98-5
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
MDL Number:
MFCD00388677
IUPAC Name:
2-(3-chloro-2-fluorophenyl)acetonitrile
InChI:
InChI=1S/C8H5ClFN/c9-7-3-1-2-6(4-5-11)8(7)10/h1-3H,4H2
InChI Key:
LJHVKGPLTKDUFW-UHFFFAOYSA-N
SMILES:
Fc1c(CC#N)cccc1Cl
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