Basic information
- Standard SMILES
O=C(N1CC=CC1)C(F)(F)F- InChIKey
LMPPMSXOYNPRQC-UHFFFAOYSA-N- Molecular formula
- C6H6F3NO
- Average molar mass
- 165.11 g/mol
- Monoisotopic mass
- 165.0401483
Names & identifiers
- Preferred name
- 1-(trifluoroacetyl)-2,5-dihydro-1H-pyrrole
- IUPAC
- 1-(2,5-dihydropyrrol-1-yl)-2,2,2-trifluoroethanone
Names & synonyms
111185-41-21-(trifluoroacetyl)-2,5-dihydro-1H-pyrrole1-(2,5-Dihydro-1H-pyrrol-1-yl)-2,2,2-trifluoroethanone1-(2,5-dihydropyrrol-1-yl)-2,2,2-trifluoroethanoneC6H6F3NO1H-Pyrrole, 2,5-dihydro-1-(trifluoroacetyl)- (9CI)MFCD180646431-(2,5-dihydro-1H-pyrrol-1-yl)-2,2,2-trifluoroethan-1-one8777AC1H-Pyrrole, 2,5-dihydro-1-(trifluoroacetyl)-NSC3405331-(2,5-Dihydro-1-pyrrolyl)-2,2,2-trifluoroethanone
Show more names
SCHEMBL5383011ALBB-0150651-trifluoroacetyl-2,5-dihydropyrroleAKOS005175058NSC-340533LS-04788SY086178DB-121827
Database identifiers
- PubChem CID
- 334666
- Nikkaji
- J698.498C
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 188
Related reactions
4 records
Compound notes
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