Home Nitriles 4-Benzyloxy-3-methoxyphenylacetonitrile

4-Benzyloxy-3-methoxyphenylacetonitrile

CAS No.:
1700-29-4
Catalog Number:
AG003KTG
Molecular Formula:
C16H15NO2
Molecular Weight:
253.2958
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$111
- +
1g
98%
In Stock USA
United States
$164
- +
Product Description
Catalog Number:
AG003KTG
Chemical Name:
4-Benzyloxy-3-methoxyphenylacetonitrile
CAS Number:
1700-29-4
Molecular Formula:
C16H15NO2
Molecular Weight:
253.2958
MDL Number:
MFCD00016394
IUPAC Name:
2-(3-methoxy-4-phenylmethoxyphenyl)acetonitrile
InChI:
InChI=1S/C16H15NO2/c1-18-16-11-13(9-10-17)7-8-15(16)19-12-14-5-3-2-4-6-14/h2-8,11H,9,12H2,1H3
InChI Key:
KSOYPRFHKIOHMY-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(c(c1)OC)OCc1ccccc1
NSC Number:
169520
Properties
Complexity:
303  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.11g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.301g/mol
Monoisotopic Mass:
253.11g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties