2-Fluoro-6-(1-hydroxyethyl)phenol
Basic information
- CAS
749929-50-8- Standard SMILES
CC(O)c1cccc(F)c1O- InChIKey
UUEPKPLTSBUURA-UHFFFAOYSA-N- Molecular formula
- C8H9FO2
- Average molar mass
- 156.15 g/mol
- Monoisotopic mass
- 156.05865769
Names & identifiers
- Preferred name
- 2-Fluoro-6-(1-hydroxyethyl)phenol
- IUPAC
- 2-fluoro-6-(1-hydroxyethyl)phenol
- English name
- Benzenemethanol, 3-fluoro-2-hydroxy-alpha-methyl- (9CI)
- Molecular formula
- C8H9FO2
- Molecular weight
- 156.1542632
Names & synonyms
2-Fluoro-6-(1-hydroxyethyl)phenol749929-50-8SCHEMBL3988512DTXSID80665393UUEPKPLTSBUURA-UHFFFAOYSA-N2-fluoro-6-(1-hydroxy-ethyl)-phenolAT22639DA-41458Benzenemethanol, 3-fluoro-2-hydroxy-α-methyl-Benzenemethanol, 3-fluoro-2-hydroxy-alpha-methyl- (9CI)
Database identifiers
- CAS
749929-50-8- PubChem CID
- 45083160
- DTXSID
DTXSID80665393
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 129
Physicochemical properties
- Boiling point
- 226.3 · 226.3±10.0 °C(Predicted)
- Density
- 1.268 · 1.268±0.06 g/cm3(Predicted)
- pka
- 8.78 · 8.78±0.40(Predicted)
Related reactions
6 records
Compound notes
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