Home Nitriles 3-[3-(Benzyloxy)phenyl]benzonitrile

3-[3-(Benzyloxy)phenyl]benzonitrile

CAS No.:
893736-89-5
Catalog Number:
AG003XAW
Molecular Formula:
C20H15NO
Molecular Weight:
285.3392
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$225
- +
Product Description
Catalog Number:
AG003XAW
Chemical Name:
3-[3-(Benzyloxy)phenyl]benzonitrile
CAS Number:
893736-89-5
Molecular Formula:
C20H15NO
Molecular Weight:
285.3392
MDL Number:
MFCD06802287
IUPAC Name:
3-(3-phenylmethoxyphenyl)benzonitrile
InChI:
InChI=1S/C20H15NO/c21-14-17-8-4-9-18(12-17)19-10-5-11-20(13-19)22-15-16-6-2-1-3-7-16/h1-13H,15H2
InChI Key:
CEAPVLJQBVTFMB-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)c1cccc(c1)OCc1ccccc1
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.115g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.346g/mol
Monoisotopic Mass:
285.115g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7  
Properties