Home Nitriles Benzonitrile, 2-fluoro-6-phenoxy-

Benzonitrile, 2-fluoro-6-phenoxy-

CAS No.:
175204-06-5
Catalog Number:
AG0020KG
Molecular Formula:
C13H8FNO
Molecular Weight:
213.2071
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Product Description
Catalog Number:
AG0020KG
Chemical Name:
Benzonitrile, 2-fluoro-6-phenoxy-
CAS Number:
175204-06-5
Molecular Formula:
C13H8FNO
Molecular Weight:
213.2071
MDL Number:
MFCD00068201
IUPAC Name:
2-fluoro-6-phenoxybenzonitrile
InChI:
InChI=1S/C13H8FNO/c14-12-7-4-8-13(11(12)9-15)16-10-5-2-1-3-6-10/h1-8H
InChI Key:
FBHXELGUZCMKQY-UHFFFAOYSA-N
SMILES:
N#Cc1c(cccc1F)Oc1ccccc1
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.059g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
213.211g/mol
Monoisotopic Mass:
213.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties