Home Halogens Benzonitrile, 2-chloro-4-fluoro-6-methyl-

Benzonitrile, 2-chloro-4-fluoro-6-methyl-

CAS No.:
1805520-76-6
Catalog Number:
AG00223S
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00223S
Chemical Name:
Benzonitrile, 2-chloro-4-fluoro-6-methyl-
CAS Number:
1805520-76-6
Molecular Formula:
C8H5ClFN
Molecular Weight:
169.5834
MDL Number:
MFCD28751892
IUPAC Name:
2-chloro-4-fluoro-6-methylbenzonitrile
InChI:
InChI=1S/C8H5ClFN/c1-5-2-6(10)3-8(9)7(5)4-11/h2-3H,1H3
InChI Key:
FZEITJQFULLZQV-UHFFFAOYSA-N
SMILES:
N#Cc1c(C)cc(cc1Cl)F
Properties
Complexity:
186  
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:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties