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Home > Pyridines > 1269376-55-7
1269376-55-7 | 1-(3-pyridinylcarbonyl)-4-piperidinone hydrochloride
CAS No: 1269376-55-7 Catalog No: AG00J1UA MDL No:MFCD18483453
Product Description
Catalog Number:
AG00J1UA
Chemical Name:
1-(3-pyridinylcarbonyl)-4-piperidinone hydrochloride
CAS Number:
1269376-55-7
Molecular Formula:
C11H13ClN2O2
Molecular Weight:
240.6861
MDL Number:
MFCD18483453
IUPAC Name:
1-(pyridine-3-carbonyl)piperidin-4-one;hydrochloride
InChI:
InChI=1S/C11H12N2O2.ClH/c14-10-3-6-13(7-4-10)11(15)9-2-1-5-12-8-9;/h1-2,5,8H,3-4,6-7H2;1H
InChI Key:
KKTBGMPFTLISOG-UHFFFAOYSA-N
SMILES:
O=C1CCN(CC1)C(=O)c1cccnc1.Cl
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.067g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.687g/mol
Monoisotopic Mass:
240.067g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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