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Home > Pyridines > 1824129-12-5
1824129-12-5 | 6-(piperidin-4-yl)-2,3-dihydropyridazin-3-one
CAS No: 1824129-12-5 Catalog No: AG018RV2 MDL No:MFCD26936284
Product Description
Catalog Number:
AG018RV2
Chemical Name:
6-(piperidin-4-yl)-2,3-dihydropyridazin-3-one
CAS Number:
1824129-12-5
Molecular Formula:
C9H13N3O
Molecular Weight:
179.2190
MDL Number:
MFCD26936284
IUPAC Name:
3-piperidin-4-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C9H13N3O/c13-9-2-1-8(11-12-9)7-3-5-10-6-4-7/h1-2,7,10H,3-6H2,(H,12,13)
InChI Key:
LVTRJDNGVHDHRK-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)C1CCNCC1
Properties
Complexity:
264
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:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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