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88584-87-6 | Piperidine, 1-(oxo-2-pyridinylacetyl)-
CAS No: 88584-87-6 Catalog No: AG004DHY MDL No:
Product Description
Catalog Number:
AG004DHY
Chemical Name:
Piperidine, 1-(oxo-2-pyridinylacetyl)-
CAS Number:
88584-87-6
Molecular Formula:
C12H14N2O2
Molecular Weight:
218.2518
IUPAC Name:
1-piperidin-1-yl-2-pyridin-2-ylethane-1,2-dione
InChI:
InChI=1S/C12H14N2O2/c15-11(10-6-2-3-7-13-10)12(16)14-8-4-1-5-9-14/h2-3,6-7H,1,4-5,8-9H2
InChI Key:
FAKVTJUTGJWCHL-UHFFFAOYSA-N
SMILES:
O=C(C(=O)N1CCCCC1)c1ccccn1
Properties
Complexity:
272
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:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.256g/mol
Monoisotopic Mass:
218.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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