3-Hydroxy-2-[4-(trifluoromethoxy)phenyl]prop-2-enal
Basic information
- CAS
808764-42-3- Standard SMILES
O=CC(=CO)c1ccc(OC(F)(F)F)cc1- InChIKey
YTIDQYKSJQHODQ-UHFFFAOYSA-N- Molecular formula
- C10H7F3O3
- Average molar mass
- 232.16 g/mol
- Monoisotopic mass
- 232.03472857
Names & identifiers
- Preferred name
- 3-Hydroxy-2-[4-(trifluoromethoxy)phenyl]prop-2-enal
- IUPAC
- 3-hydroxy-2-[4-(trifluoromethoxy)phenyl]prop-2-enal
Names & synonyms
3-hydroxy-2-[4-(trifluoromethoxy)phenyl]prop-2-enalDTXSID001183584808764-42-3I+/--(Hydroxymethylene)-4-(trifluoromethoxy)benzeneacetaldehyde
Database identifiers
- CAS
808764-42-3- PubChem CID
- 4655833
- DTXSID
DTXSID001183584
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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