Basic information
- Standard SMILES
CCOCn1c(-c2ccc(Cl)cc2)c(C#N)c(Cl)c1C(F)(F)F- InChIKey
QSBZRRKSQSAYKF-UHFFFAOYSA-N- Molecular formula
- C15H11Cl2F3N2O
- Average molar mass
- 363.2 g/mol
Names & identifiers
- Preferred name
- 4-Chloro-2-(p-chlorophenyl)-1-(ethoxymethyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile
- IUPAC
- 4-chloro-2-(4-chlorophenyl)-1-(ethoxymethyl)-5-(trifluoromethyl)pyrrole-3-carbonitrile
Names & synonyms
4-Chloro-2-(p-chlorophenyl)-1-(ethoxymethyl)-5-(trifluoromethyl)pyrrole-3-carbonitrileSCHEMBL58125584-Chloro-2-(p-chlorophenyl)-1-(ethoxymethyl) -5-(trifluoromethyl)pyrrole-3-carbonitrile
Database identifiers
- PubChem CID
- 11111246
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 38 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 446
Related reactions
2 records
Compound notes
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