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Home > Pyridines > 1426291-22-6
1426291-22-6 | 6-(PIPERIDIN-3-YLOXY)PYRIDAZIN-3(2H)-ONE HYDROCHLORIDE
CAS No: 1426291-22-6 Catalog No: AG01AQSW MDL No:MFCD16652942
Product Description
Catalog Number:
AG01AQSW
Chemical Name:
6-(PIPERIDIN-3-YLOXY)PYRIDAZIN-3(2H)-ONE HYDROCHLORIDE
CAS Number:
1426291-22-6
Molecular Formula:
C9H14ClN3O2
Molecular Weight:
231.6794
MDL Number:
MFCD16652942
IUPAC Name:
3-piperidin-3-yloxy-1H-pyridazin-6-one;hydrochloride
InChI:
InChI=1S/C9H13N3O2.ClH/c13-8-3-4-9(12-11-8)14-7-2-1-5-10-6-7;/h3-4,7,10H,1-2,5-6H2,(H,11,13);1H
InChI Key:
YDINXIRFHDMIOG-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)OC1CCCNC1.Cl
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.077g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
231.68g/mol
Monoisotopic Mass:
231.077g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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