Basic information
- CAS
205056-38-8- Standard SMILES
CC(=O)N1N=C(C)CCC1=O- InChIKey
FHCYONZKAZJFMK-UHFFFAOYSA-N- Molecular formula
- C7H10N2O2
- Average molar mass
- 154.17 g/mol
Names & identifiers
- Preferred name
- 2-Acetyl-6-methyl-4,5-dihydropyridazin-3(2H)-one
- IUPAC
- 2-acetyl-6-methyl-4,5-dihydropyridazin-3-one
- English name
- 3(2H)-Pyridazinone, 2-acetyl-4,5-dihydro-6-methyl- (9CI)
- Molecular formula
- C7H10N2O2
- Molecular weight
- 154.17
Names & synonyms
205056-38-82-Acetyl-6-methyl-4,5-dihydropyridazin-3(2H)-oneSCHEMBL28979901DB-2827403(2H)-Pyridazinone, 2-acetyl-4,5-dihydro-6-methyl-3(2H)-Pyridazinone, 2-acetyl-4,5-dihydro-6-methyl- (9CI)
Database identifiers
- CAS
205056-38-8
Properties
Computed structural properties
- XLogP
- -0.8
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 233
Physicochemical properties
- Boiling point
- 246.5 · 246.5±23.0 °C(Predicted)
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- -0.22 · -0.22±0.20(Predicted)
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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