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Home > Pyridines > 126832-81-3
126832-81-3 | 4-Piperidinone, 1-(4-pyridinyl)-
CAS No: 126832-81-3 Catalog No: AG000TB6 MDL No:MFCD09030756
Product Description
Catalog Number:
AG000TB6
Chemical Name:
4-Piperidinone, 1-(4-pyridinyl)-
CAS Number:
126832-81-3
Molecular Formula:
C10H12N2O
Molecular Weight:
176.2151
MDL Number:
MFCD09030756
IUPAC Name:
1-pyridin-4-ylpiperidin-4-one
InChI:
InChI=1S/C10H12N2O/c13-10-3-7-12(8-4-10)9-1-5-11-6-2-9/h1-2,5-6H,3-4,7-8H2
InChI Key:
MAXMUBIIZUKOJF-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)c1ccncc1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.219g/mol
Monoisotopic Mass:
176.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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