Home Halogens 4-(3-chloro-4-fluorophenoxy)-3-fluorobenzonitrile

4-(3-chloro-4-fluorophenoxy)-3-fluorobenzonitrile

CAS No.:
1410890-97-9
Catalog Number:
AG01A6HC
Molecular Formula:
C13H6ClF2NO
Molecular Weight:
265.6426
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Product Description
Catalog Number:
AG01A6HC
Chemical Name:
4-(3-chloro-4-fluorophenoxy)-3-fluorobenzonitrile
CAS Number:
1410890-97-9
Molecular Formula:
C13H6ClF2NO
Molecular Weight:
265.6426
MDL Number:
MFCD19018400
IUPAC Name:
4-(3-chloro-4-fluorophenoxy)-3-fluorobenzonitrile
InChI:
InChI=1S/C13H6ClF2NO/c14-10-6-9(2-3-11(10)15)18-13-4-1-8(7-17)5-12(13)16/h1-6H
InChI Key:
OHPWZZGPCCYNLY-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(c1)F)Oc1ccc(c(c1)Cl)F
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.011g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
265.644g/mol
Monoisotopic Mass:
265.011g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties