Home Nitriles 2-(Benzyloxy)-5-fluorobenzonitrile

2-(Benzyloxy)-5-fluorobenzonitrile

CAS No.:
945614-14-2
Catalog Number:
AG00IICA
Molecular Formula:
C14H10FNO
Molecular Weight:
227.2337
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00IICA
Chemical Name:
2-(Benzyloxy)-5-fluorobenzonitrile
CAS Number:
945614-14-2
Molecular Formula:
C14H10FNO
Molecular Weight:
227.2337
MDL Number:
MFCD18204992
IUPAC Name:
5-fluoro-2-phenylmethoxybenzonitrile
InChI:
InChI=1S/C14H10FNO/c15-13-6-7-14(12(8-13)9-16)17-10-11-4-2-1-3-5-11/h1-8H,10H2
InChI Key:
URIQKEYISJKWRU-UHFFFAOYSA-N
SMILES:
N#Cc1cc(F)ccc1OCc1ccccc1
Properties
Complexity:
279  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.075g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.238g/mol
Monoisotopic Mass:
227.075g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties