[3-[4-[(2,4-Dichlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methylphenyl)methanone
Basic information
- CAS
477711-54-9- Standard SMILES
Cc1ccc(C(=O)n2ccc(-c3ccc(OCc4ccc(Cl)cc4Cl)cc3)n2)cc1- InChIKey
WTSMGXVHJOVANI-UHFFFAOYSA-N- Molecular formula
- C24H18Cl2N2O2
- Average molar mass
- 437.3 g/mol
Names & identifiers
- Preferred name
- [3-[4-[(2,4-Dichlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methylphenyl)methanone
- IUPAC
- [3-[4-[(2,4-dichlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methylphenyl)methanone
- English name
- (3-(4-[(2,4-Dichlorobenzyl)oxy]phenyl)-1H-pyrazol-1-yl)(4-methylphenyl)methanone
- Molecular formula
- C24H18Cl2N2O2
- Molecular weight
- 437.32
Names & synonyms
477711-54-9[3-[4-[(2,4-dichlorophenyl)methoxy]phenyl]pyrazol-1-yl]-(4-methylphenyl)methanone(3-{4-[(2,4-dichlorobenzyl)oxy]phenyl}-1H-pyrazol-1-yl)(4-methylphenyl)methanone3-{4-[(2,4-dichlorophenyl)methoxy]phenyl}-1-(4-methylbenzoyl)-1H-pyrazoleAKOS0050890893R-0030(3-(4-((2,4-Dichlorobenzyl)oxy)phenyl)-1H-pyrazol-1-yl)(p-tolyl)methanone(3-(4-[(2,4-Dichlorobenzyl)oxy]phenyl)-1H-pyrazol-1-yl)(4-methylphenyl)methanoneMethanone, [3-[4-[(2,4-dichlorophenyl)methoxy]phenyl]-1H-pyrazol-1-yl](4-methylphenyl)-
Database identifiers
- CAS
477711-54-9
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 561
Physicochemical properties
- Boiling point
- 622.7 · 622.7±65.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
- pka
- -1.73 · -1.73±0.12(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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