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78784-65-3 | 3(2H)-Pyridazinone, 6-(3-pyridinyl)-
CAS No: 78784-65-3 Catalog No: AG005DHS MDL No:MFCD09033893
Product Description
Catalog Number:
AG005DHS
Chemical Name:
3(2H)-Pyridazinone, 6-(3-pyridinyl)-
CAS Number:
78784-65-3
Molecular Formula:
C9H7N3O
Molecular Weight:
173.1714
MDL Number:
MFCD09033893
IUPAC Name:
3-pyridin-3-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C9H7N3O/c13-9-4-3-8(11-12-9)7-2-1-5-10-6-7/h1-6H,(H,12,13)
InChI Key:
OQYCHIKONQFIQO-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)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:
173.059g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
173.175g/mol
Monoisotopic Mass:
173.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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