3-Chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)pyrrole-2,5-dione
Basic information
- CAS
303034-88-0- Standard SMILES
CCOc1ccc(NC2=C(Cl)C(=O)N(c3ccccc3C)C2=O)cc1- InChIKey
LCSJOLGRAQQOHU-UHFFFAOYSA-N- Molecular formula
- C19H17ClN2O3
- Average molar mass
- 356.8 g/mol
Names & identifiers
- Preferred name
- 3-Chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)pyrrole-2,5-dione
- IUPAC
- 3-chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)pyrrole-2,5-dione
- English name
- 3-chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)-1H-pyrrole-2,5-dione
- Molecular formula
- C19H17ClN2O3
- Molecular weight
- 356.8
Names & synonyms
303034-88-03-chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)pyrrole-2,5-dione3-chloro-4-(4-ethoxyanilino)-1-(2-methylphenyl)-1H-pyrrole-2,5-dioneSTL331652AKOS002263980ST50189472AF-399/14183715SR-01000229578SR-01000229578-13-chloro-4-((4-ethoxyphenyl)amino)-1-(o-tolyl)-1H-pyrrole-2,5-dione3-chloro-4-[(4-ethoxyphenyl)amino]-1-(2-methylphenyl)azoline-2,5-dione3-chloro-4-[(4-ethoxyphenyl)amino]-1-(2-methylphenyl)-1H-pyrrole-2,5-dione
Show more names
1H-Pyrrole-2,5-dione, 3-chloro-4-[(4-ethoxyphenyl)amino]-1-(2-methylphenyl)-
Database identifiers
- CAS
303034-88-0
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 555
Physicochemical properties
- Boiling point
- 468.5 · 468.5±45.0 °C(Predicted)
- Density
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- pka
- -1.97 · -1.97±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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