Basic information
- Standard SMILES
COC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)oc1COC(C)=O- InChIKey
HVPOCSVPFHGLGI-UHFFFAOYSA-N- Molecular formula
- C16H13F3O5
- Average molar mass
- 342.27 g/mol
Names & identifiers
- Preferred name
- Methyl 2-(acetyloxymethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-carboxylate
- IUPAC
- methyl 2-(acetyloxymethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-carboxylate
Names & synonyms
SCHEMBL3905258HVPOCSVPFHGLGI-UHFFFAOYSA-Nmethyl 2-(acetyloxymethyl)-5-[4-(trifluoromethyl)phenyl]furan-3-carboxylate
Database identifiers
- PubChem CID
- 57728581
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 457
Related reactions
1 records
Compound notes
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