5-Ethyl-4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde
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Basic information
- Standard SMILES
CCc1[nH]c(C=O)nc1C(F)(F)F- InChIKey
UBARSQNMFYJBNI-UHFFFAOYSA-N- Molecular formula
- C7H7F3N2O
- Average molar mass
- 192.14 g/mol
- Monoisotopic mass
- 192.05104734
Names & identifiers
- Preferred name
- 5-Ethyl-4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde
- IUPAC
- 5-ethyl-4-(trifluoromethyl)-1H-imidazole-2-carbaldehyde
Names & synonyms
5-Ethyl-4-(trifluoromethyl)-1H-imidazole-2-carbaldehydeSCHEMBL2826210
Database identifiers
- PubChem CID
- 86648487
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 195
Related reactions
5 records
Compound notes
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