Basic information
- Standard SMILES
COC/C=C/c1cc(C=O)cc(C(F)(F)F)c1- InChIKey
HMRSTMZOZAUWRA-NSCUHMNNSA-N- Molecular formula
- C12H11F3O2
- Average molar mass
- 244.21 g/mol
Names & identifiers
- Preferred name
- 3-[(1E)-3-Methoxyprop-1-en-1-yl]-5-(trifluoromethyl)benzaldehyde
- IUPAC
- 3-[(E)-3-methoxyprop-1-enyl]-5-(trifluoromethyl)benzaldehyde
Names & synonyms
3-[(1E)-3-Methoxyprop-1-en-1-yl]-5-(trifluoromethyl)benzaldehydeSCHEMBL1518565
Database identifiers
- PubChem CID
- 86651682
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 273
Related reactions
2 records
Compound notes
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