Home Nitriles 2-Chloro-6-fluorophenylacetonitrile

2-Chloro-6-fluorophenylacetonitrile

CAS No.:
75279-55-9
Catalog Number:
AG003H0J
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
In Stock USA
United States
$132
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Product Description
Catalog Number:
AG003H0J
Chemical Name:
2-Chloro-6-fluorophenylacetonitrile
CAS Number:
75279-55-9
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
MDL Number:
MFCD00001900
IUPAC Name:
2-(2-chloro-6-fluorophenyl)acetonitrile
InChI:
InChI=1S/C8H5ClFN/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3H,4H2
InChI Key:
ZGSAFMIRVLOISC-UHFFFAOYSA-N
SMILES:
N#CCc1c(F)cccc1Cl
EC Number:
278-171-8
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