Basic information
- Standard SMILES
C#CC(O)(C(F)(F)F)C(F)(F)F- InChIKey
SUXMSLHCUKVRGQ-UHFFFAOYSA-N- Molecular formula
- C5H2F6O
- Average molar mass
- 192.06 g/mol
Names & identifiers
- Preferred name
- 1,1,1-Trifluoro-2-trifluoromethyl-but-3-yn-2-ol
- IUPAC
- 1,1,1-trifluoro-2-(trifluoromethyl)but-3-yn-2-ol
Names & synonyms
1,1,1-trifluoro-2-trifluoromethyl-but-3-yn-2-ol646-72-0SCHEMBL648870orb26453591,1,1-trifluoro-2-(trifluoromethyl)but-3-yn-2-ol
Database identifiers
- PubChem CID
- 13667828
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 200
Related reactions
5 records
Compound notes
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