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Home > Pyridines > 1593926-28-3
1593926-28-3 | 6-(piperidin-3-yl)pyridazin-3-ol
CAS No: 1593926-28-3 Catalog No: AG01AF5J MDL No:MFCD26936285
Product Description
Catalog Number:
AG01AF5J
Chemical Name:
6-(piperidin-3-yl)pyridazin-3-ol
CAS Number:
1593926-28-3
Molecular Formula:
C9H13N3O
Molecular Weight:
179.2190
MDL Number:
MFCD26936285
IUPAC Name:
3-piperidin-3-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C9H13N3O/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7/h3-4,7,10H,1-2,5-6H2,(H,12,13)
InChI Key:
PAYAFKZYSVLKNW-UHFFFAOYSA-N
SMILES:
Oc1ccc(nn1)C1CCCNC1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.106g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
179.223g/mol
Monoisotopic Mass:
179.106g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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