Basic information
- Standard SMILES
O=C(O)c1ccc(OCc2ccccc2)c(C(F)(F)F)c1- InChIKey
MDUDZLWMGWNCIQ-UHFFFAOYSA-N- Molecular formula
- C15H11F3O3
- Average molar mass
- 296.24 g/mol
Names & identifiers
- Preferred name
- 4-(Benzyloxy)-3-(trifluoromethyl)benzoic acid
- IUPAC
- 4-phenylmethoxy-3-(trifluoromethyl)benzoic acid
Names & synonyms
4-(Benzyloxy)-3-(trifluoromethyl)benzoic acid536975-35-64-Benzyloxy-3-trifluoromethyl-benzoic AcidMFCD124056534-benzyloxy-3-trifluoromethylbenzoic acid4-phenylmethoxy-3-(trifluoromethyl)benzoic acidSCHEMBL79709AKOS0126247064-benzyloxy-3-(trifluoromethyl)benzoic acidCS-0192469E90724F630202
Show more names
A1-08045
Database identifiers
- PubChem CID
- 16749023
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 351
Related reactions
10 records
Compound notes
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