Home Halogens 2-chloro-2-(2-chloro-6-fluorophenyl)acetonitrile

2-chloro-2-(2-chloro-6-fluorophenyl)acetonitrile

CAS No.:
1249456-66-3
Catalog Number:
AG01AIVI
Molecular Formula:
C8H4Cl2FN
Molecular Weight:
204.0285
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Product Description
Catalog Number:
AG01AIVI
Chemical Name:
2-chloro-2-(2-chloro-6-fluorophenyl)acetonitrile
CAS Number:
1249456-66-3
Molecular Formula:
C8H4Cl2FN
Molecular Weight:
204.0285
MDL Number:
MFCD16147003
IUPAC Name:
2-chloro-2-(2-chloro-6-fluorophenyl)acetonitrile
InChI:
InChI=1S/C8H4Cl2FN/c9-5-2-1-3-7(11)8(5)6(10)4-12/h1-3,6H
InChI Key:
FSOVTOZIYHZIDE-UHFFFAOYSA-N
SMILES:
N#CC(c1c(F)cccc1Cl)Cl
Properties
Complexity:
201  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.97g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.025g/mol
Monoisotopic Mass:
202.97g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties