Basic information
- CAS
75872-28-5- Standard SMILES
CC(=O)c1nn(-c2ccccc2)c(=O)cc1C- InChIKey
BMCQBSWGDOFMAH-UHFFFAOYSA-N- Molecular formula
- C13H12N2O2
- Average molar mass
- 228.25 g/mol
- Monoisotopic mass
- 228.08987763
Names & identifiers
- Preferred name
- 6-Acetyl-5-methyl-2-phenylpyridazin-3(2H)-one
- IUPAC
- 6-acetyl-5-methyl-2-phenylpyridazin-3-one
Names & synonyms
75872-28-5NSC3504936-Acetyl-5-methyl-2-phenylpyridazin-3(2H)-oneDTXSID20319782NSC-3504936-acetyl-5-methyl-2-phenyl-3(2H)-pyridazinone
Database identifiers
- CAS
75872-28-5- PubChem CID
- 336396
- DTXSID
DTXSID20319782- Nikkaji
- J2.528.647B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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