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Home > Pyridines > 2105838-79-5
2105838-79-5 | 5-(4-piperidinylmethyl)-2(1H)-pyridinone dihydrochloride
CAS No: 2105838-79-5 Catalog No: AG00J2VR MDL No:MFCD30718763
Product Description
Catalog Number:
AG00J2VR
Chemical Name:
5-(4-piperidinylmethyl)-2(1H)-pyridinone dihydrochloride
CAS Number:
2105838-79-5
Molecular Formula:
C11H18Cl2N2O
Molecular Weight:
265.1794
MDL Number:
MFCD30718763
IUPAC Name:
5-(piperidin-4-ylmethyl)-1H-pyridin-2-one;dihydrochloride
InChI:
InChI=1S/C11H16N2O.2ClH/c14-11-2-1-10(8-13-11)7-9-3-5-12-6-4-9;;/h1-2,8-9,12H,3-7H2,(H,13,14);2*1H
InChI Key:
HBXBHOXUNTYSMW-UHFFFAOYSA-N
SMILES:
O=c1ccc(c[nH]1)CC1CCNCC1.Cl.Cl
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
265.178g/mol
Monoisotopic Mass:
264.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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