Basic information
- Standard SMILES
Oc1ccc(C(c2ccccc2)(c2ccc(O)cc2)C(F)(F)F)cc1- InChIKey
MQTKRZKZCDBRIG-UHFFFAOYSA-N- Molecular formula
- C20H15F3O2
- Average molar mass
- 344.3 g/mol
- Monoisotopic mass
- 344.10241438
Names & identifiers
- Preferred name
- 4,4'-(2,2,2-Trifluoro-1-phenylethane-1,1-diyl)diphenol
- IUPAC
- 4-[2,2,2-trifluoro-1-(4-hydroxyphenyl)-1-phenylethyl]phenol
Names & synonyms
4,4'-(2,2,2-trifluoro-1-phenylethane-1,1-diyl)diphenol1882-01-5DTXSID50597298Phenol, 4,4'-(2,2,2-trifluoro-1-phenylethylidene)bis-RefChem:284453DTXCID00548058MQTKRZKZCDBRIG-UHFFFAOYSA-N1,1-bis(4-hydroxyphenyl)-1-phenyl-2,2,2-trifluoroethaneSCHEMBL11714821,1-bis(4-hydroxyphenyl)-l-phenyl-2,2,2-trifluoroethane1,1-bis-(4-hydroxyphenyl)-1-phenyl-2,2,2-trifluoroethane1,1-bis-(4-hydroxyphenyl)-l-phenyl-2,2,2-trifluoroethane
Database identifiers
- CAS
1882-01-5- PubChem CID
- 19005175
- DTXSID
DTXSID50597298- Nikkaji
- J846.332H
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 393
Related reactions
4 records
Linked notes
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