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Home > Pyridines > 1287217-93-9
1287217-93-9 | 6-(Tetrahydro-2H-pyran-2-ylmethoxy)pyridine-2-carbonitrile
CAS No: 1287217-93-9 Catalog No: AG01F71J MDL No:
Product Description
Catalog Number:
AG01F71J
Chemical Name:
6-(Tetrahydro-2H-pyran-2-ylmethoxy)pyridine-2-carbonitrile
CAS Number:
1287217-93-9
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
IUPAC Name:
6-(oxan-2-ylmethoxy)pyridine-2-carbonitrile
InChI:
InChI=1S/C12H14N2O2/c13-8-10-4-3-6-12(14-10)16-9-11-5-1-2-7-15-11/h3-4,6,11H,1-2,5,7,9H2
InChI Key:
ZSPDRJLTCSSKHP-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(n1)OCC1CCCCO1
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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