Basic information
- Standard SMILES
O=S(=O)(O)CC(c1ccccc1)C(F)(F)F- InChIKey
DSCCICBHYLYNDS-UHFFFAOYSA-N- Molecular formula
- C9H9F3O3S
- Average molar mass
- 254.23 g/mol
Names & identifiers
- Preferred name
- 3,3,3-Trifluoro-2-phenylpropane-1-sulfonic acid
- IUPAC
- 3,3,3-trifluoro-2-phenylpropane-1-sulfonic acid
Names & synonyms
SCHEMBL7859422DSCCICBHYLYNDS-UHFFFAOYSA-N3,3,3-trifluoro-2-phenylpropane-1-sulfonic acid
Database identifiers
- PubChem CID
- 21714404
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 312
Related reactions
1 records
Compound notes
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