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Home > Pyridines > 116248-07-8

116248-07-8

116248-07-8 | 3-Pyridinecarbonitrile, 6-(4-oxo-1-piperidinyl)-

CAS No: 116248-07-8 Catalog No: AG000C17 MDL No:

Product Description

Catalog Number:
AG000C17
Chemical Name:
3-Pyridinecarbonitrile, 6-(4-oxo-1-piperidinyl)-
CAS Number:
116248-07-8
Molecular Formula:
C11H11N3O
Molecular Weight:
201.2245
IUPAC Name:
6-(4-oxopiperidin-1-yl)pyridine-3-carbonitrile
InChI:
InChI=1S/C11H11N3O/c12-7-9-1-2-11(13-8-9)14-5-3-10(15)4-6-14/h1-2,8H,3-6H2
InChI Key:
QLKYOINYKWSUIO-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)N1CCC(=O)CC1

Properties

Complexity:
284  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.09g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.229g/mol
Monoisotopic Mass:
201.09g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
57A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

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