Basic information
- CAS
2860-64-2- Standard SMILES
CC1CCN(c2ccc(Cl)c(Cl)c2)C1=O- InChIKey
SMCOGDOFPLWPDT-UHFFFAOYSA-N- Molecular formula
- C11H11Cl2NO
- Average molar mass
- 244.11 g/mol
- Monoisotopic mass
- 243.0217694
Names & identifiers
- Preferred name
- 1-(3,4-Dichlorophenyl)-3-methylpyrrolidin-2-one
- IUPAC
- 1-(3,4-dichlorophenyl)-3-methylpyrrolidin-2-one
Names & synonyms
1-(3,4-dichlorophenyl)-3-methylpyrrolidin-2-one2860-64-2BV 201SCHEMBL11212875DTXSID50951270
Database identifiers
- CAS
2860-64-2- PubChem CID
- 17862
- DTXSID
DTXSID50951270- Nikkaji
- J1.559.262A
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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