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

4-(3-chloro-4-fluorophenoxy)benzonitrile

CAS No.:
1461715-65-0
Catalog Number:
AG01A6L3
Molecular Formula:
C13H7ClFNO
Molecular Weight:
247.6522
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Product Description
Catalog Number:
AG01A6L3
Chemical Name:
4-(3-chloro-4-fluorophenoxy)benzonitrile
CAS Number:
1461715-65-0
Molecular Formula:
C13H7ClFNO
Molecular Weight:
247.6522
MDL Number:
MFCD18919960
IUPAC Name:
4-(3-chloro-4-fluorophenoxy)benzonitrile
InChI:
InChI=1S/C13H7ClFNO/c14-12-7-11(5-6-13(12)15)17-10-3-1-9(8-16)2-4-10/h1-7H
InChI Key:
AJNPYPSQCNHRGG-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cc1)Oc1ccc(c(c1)Cl)F
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.02g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.653g/mol
Monoisotopic Mass:
247.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties