Basic information
- Standard SMILES
Cc1cc(O)cc(OCc2ccccc2C(F)(F)F)c1- InChIKey
ATGPJLSWPLCROE-UHFFFAOYSA-N- Molecular formula
- C15H13F3O2
- Average molar mass
- 282.26 g/mol
- Monoisotopic mass
- 282.08676414
Names & identifiers
- Preferred name
- 5-Methyl-3-(2-trifluoromethylbenzyloxy)phenol
- IUPAC
- 3-methyl-5-[[2-(trifluoromethyl)phenyl]methoxy]phenol
Names & synonyms
5-Methyl-3-(2-trifluoromethylbenzyloxy)phenolSCHEMBL5674221
Database identifiers
- PubChem CID
- 53661060
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 306
Related reactions
2 records
Compound notes
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