4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethoxy)phenol
Basic information
- Standard SMILES
CC1(C)OB(c2ccc(O)c(OC(F)(F)F)c2)OC1(C)C- InChIKey
KFEICRNRUSAILQ-UHFFFAOYSA-N- Molecular formula
- C13H16BF3O4
- Average molar mass
- 304.07 g/mol
- Monoisotopic mass
- 304.1093736
Names & identifiers
- Preferred name
- 4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethoxy)phenol
- IUPAC
- 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethoxy)phenol
Names & synonyms
4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethoxy)phenol1350989-48-8MFCD18756764SCHEMBL15191141AKOS027390960AT12807BS-40701CS-0356645F3305301-Hydroxy-2-(trifluoromethoxy)-benzene-4-boronic Acid Pinacol esterPhenol, 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethoxy)-
Database identifiers
- PubChem CID
- 74789482
Properties
Computed structural properties
- Topological polar surface area
- 47.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 370
Related reactions
3 records
Compound notes
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