Home Nitriles 2-[6-(benzyloxy)pyridin-3-yl]acetonitrile

2-[6-(benzyloxy)pyridin-3-yl]acetonitrile

CAS No.:
1803566-36-0
Catalog Number:
AG01B9NS
Molecular Formula:
C14H12N2O
Molecular Weight:
224.2579
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Product Description
Catalog Number:
AG01B9NS
Chemical Name:
2-[6-(benzyloxy)pyridin-3-yl]acetonitrile
CAS Number:
1803566-36-0
Molecular Formula:
C14H12N2O
Molecular Weight:
224.2579
MDL Number:
MFCD18205225
IUPAC Name:
2-(6-phenylmethoxypyridin-3-yl)acetonitrile
InChI:
InChI=1S/C14H12N2O/c15-9-8-12-6-7-14(16-10-12)17-11-13-4-2-1-3-5-13/h1-7,10H,8,11H2
InChI Key:
PMOYGWJYHNTOON-UHFFFAOYSA-N
SMILES:
N#CCc1ccc(nc1)OCc1ccccc1
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.095g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.263g/mol
Monoisotopic Mass:
224.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties