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23227-96-5 | 3(2H)-Pyridazinone, 4,5-dihydro-4,6-dimethyl-
CAS No: 23227-96-5 Catalog No: AG002MKS MDL No:
Product Description
Catalog Number:
AG002MKS
Chemical Name:
3(2H)-Pyridazinone, 4,5-dihydro-4,6-dimethyl-
CAS Number:
23227-96-5
Molecular Formula:
C6H10N2O
Molecular Weight:
126.1564
IUPAC Name:
3,5-dimethyl-4,5-dihydro-1H-pyridazin-6-one
InChI:
InChI=1S/C6H10N2O/c1-4-3-5(2)7-8-6(4)9/h4H,3H2,1-2H3,(H,8,9)
InChI Key:
KJZAENJNBTVSJU-UHFFFAOYSA-N
SMILES:
O=C1NN=C(CC1C)C
Properties
Complexity:
162
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
126.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
126.159g/mol
Monoisotopic Mass:
126.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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