4(1H)-Pyridazinone, 3-methoxy-1-(3-(trifluoromethyl)phenyl)-
Basic information
- CAS
146824-82-0- Standard SMILES
COc1nn(-c2cccc(C(F)(F)F)c2)ccc1=O- InChIKey
WUNKIZHCEIZRCI-UHFFFAOYSA-N- Molecular formula
- C12H9F3N2O2
- Average molar mass
- 270.21 g/mol
- Monoisotopic mass
- 270.06161202
Names & identifiers
- Preferred name
- 4(1H)-Pyridazinone, 3-methoxy-1-(3-(trifluoromethyl)phenyl)-
- IUPAC
- 3-methoxy-1-[3-(trifluoromethyl)phenyl]pyridazin-4-one
Names & synonyms
4(1H)-Pyridazinone, 3-methoxy-1-(3-(trifluoromethyl)phenyl)-3-Methoxy-1-(3-(trifluoromethyl)phenyl)-4(1H)-pyridazinone146824-82-0m-Trifluoromethyl phenyl-1 dihydro-1,4 methoxy-3 oxo-4 pyridazine [French]DTXSID70163510m-Trifluoromethyl phenyl-1 dihydro-1,4 methoxy-3 oxo-4 pyridazineRefChem:283497DTXCID50860013-Methoxy-1-[3-(trifluoromethyl)phenyl]pyridazin-4(1H)-one
Database identifiers
- CAS
146824-82-0- PubChem CID
- 3073152
- DTXSID
DTXSID70163510
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 418
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Compound notes
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