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73259-08-2 | 6-(3,5-dimethyl-1H-pyrazol-1-yl)pyridazin-3-ol
CAS No: 73259-08-2 Catalog No: AG018BNX MDL No:MFCD00586363
Product Description
Catalog Number:
AG018BNX
Chemical Name:
6-(3,5-dimethyl-1H-pyrazol-1-yl)pyridazin-3-ol
CAS Number:
73259-08-2
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
MDL Number:
MFCD00586363
IUPAC Name:
3-(3,5-dimethylpyrazol-1-yl)-1H-pyridazin-6-one
InChI:
InChI=1S/C9H10N4O/c1-6-5-7(2)13(12-6)8-3-4-9(14)11-10-8/h3-5H,1-2H3,(H,11,14)
InChI Key:
BZPBXAFQGVLSFI-UHFFFAOYSA-N
SMILES:
Oc1ccc(nn1)n1nc(cc1C)C
Properties
Complexity:
310
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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