2-Fluoro-4-(piperidin-4-yl)phenol
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Basic information
- CAS
1260871-71-3- Standard SMILES
Oc1ccc(C2CCNCC2)cc1F- InChIKey
IERGXBBYHGFWCI-UHFFFAOYSA-N- Molecular formula
- C11H14FNO
- Average molar mass
- 195.23 g/mol
Names & identifiers
- Preferred name
- 2-Fluoro-4-(piperidin-4-yl)phenol
- IUPAC
- 2-fluoro-4-piperidin-4-ylphenol
- English name
- 2-Fluoro-4-(piperidin-4-yl)phenol hydrochloride
- Molecular formula
- C11H14FNO
- Molecular weight
- 195.23
Names & synonyms
2-Fluoro-4-(piperidin-4-yl)phenol1260871-71-32-Fluoro-4-piperidin-4-ylphenolSCHEMBL215273342-Fluoro-4-(4-piperidinyl)phenolDB-409664EN300-1834296Phenol, 2-fluoro-4-(4-piperidinyl)-2-Fluoro-4-(piperidin-4-yl)phenol hydrochloride
Database identifiers
- CAS
1260871-71-3
Properties
Computed structural propertiesFilling in
- XLogP
- 1.8
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- Boiling point
- 301.1 · 301.1±42.0 °C(Predicted)
- Density
- 1.153 · 1.153±0.06 g/cm3(Predicted)
- pka
- 8.77 · 8.77±0.35(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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