1-(p-Tolyl)-5-(trifluoromethyl)-pyrrolidin-2-one
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Basic information
- CAS
134481-29-1- Standard SMILES
Cc1ccc(N2C(=O)CCC2C(F)(F)F)cc1- InChIKey
ZZLAPTJIPAVITR-UHFFFAOYSA-N- Molecular formula
- C12H12F3NO
- Average molar mass
- 243.22 g/mol
- Monoisotopic mass
- 243.08709849
Names & identifiers
- Preferred name
- 1-(p-Tolyl)-5-(trifluoromethyl)-pyrrolidin-2-one
- IUPAC
- 1-(4-methylphenyl)-5-(trifluoromethyl)pyrrolidin-2-one
- English name
- 1-P-TOLYL-5-TRIFLUOROMETHYL-PYRROLIDIN-2-ONE
- Molecular formula
- C12H12F3NO
- Molecular weight
- 243.2249896
Names & synonyms
134481-29-11-(4-METHYLPHENYL)-5-(TRIFLUOROMETHYL)PYRROLIDIN-2-ONE1-(p-tolyl)-5-(trifluoromethyl)-pyrrolidin-2-one1-(4-methylphenyl)-5-(trifluoromethyl)-2-pyrrolidinone1-P-TOLYL-5-TRIFLUOROMETHYL-PYRROLIDIN-2-ONE
Database identifiers
- CAS
134481-29-1- PubChem CID
- 24978071
Properties
Computed structural propertiesFilling in
- XLogP
- 2.9
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 295
Related reactions
0 records
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Compound notes
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