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Home > Pyridines > 1016812-22-8
1016812-22-8 | 3-Pyridinecarbonitrile, 2-(cyclohexyloxy)-
CAS No: 1016812-22-8 Catalog No: AG00056R MDL No:MFCD09943149
Product Description
Catalog Number:
AG00056R
Chemical Name:
3-Pyridinecarbonitrile, 2-(cyclohexyloxy)-
CAS Number:
1016812-22-8
Molecular Formula:
C12H14N2O
Molecular Weight:
202.2524
MDL Number:
MFCD09943149
IUPAC Name:
2-cyclohexyloxypyridine-3-carbonitrile
InChI:
InChI=1S/C12H14N2O/c13-9-10-5-4-8-14-12(10)15-11-6-2-1-3-7-11/h4-5,8,11H,1-3,6-7H2
InChI Key:
VVMPGKGYTJRBCO-UHFFFAOYSA-N
SMILES:
N#Cc1cccnc1OC1CCCCC1
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.257g/mol
Monoisotopic Mass:
202.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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