3,3,4,4,4-Pentafluoro-2-phenylbutan-2-ol
Basic information
- CAS
101417-69-0- Standard SMILES
CC(O)(c1ccccc1)C(F)(F)C(F)(F)F- InChIKey
DGNSCPCUDMFPMG-UHFFFAOYSA-N- Molecular formula
- C10H9F5O
- Average molar mass
- 240.17 g/mol
- Monoisotopic mass
- 240.05735572
Names & identifiers
- Preferred name
- 3,3,4,4,4-Pentafluoro-2-phenylbutan-2-ol
- IUPAC
- 3,3,4,4,4-pentafluoro-2-phenylbutan-2-ol
Names & synonyms
3,3,4,4,4-Pentafluoro-2-phenylbutan-2-ol101417-69-0C10H9F5OSCHEMBL21135302DGNSCPCUDMFPMG-UHFFFAOYSA-NDTXSID201023128AKOS0252125583,3,4,4,4-pentafluoro-2-phenyl-butan-2-ol
Database identifiers
- CAS
101417-69-0- PubChem CID
- 13495697
- DTXSID
DTXSID201023128
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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