4-[(Trifluoromethyl)sulfonyl]phenyl acetate
Basic information
- Standard SMILES
CC(=O)Oc1ccc(S(=O)(=O)C(F)(F)F)cc1- InChIKey
BGEOAJGTGTXLTD-UHFFFAOYSA-N- Molecular formula
- C9H7F3O4S
- Average molar mass
- 268.21 g/mol
Names & identifiers
- Preferred name
- 4-[(Trifluoromethyl)sulfonyl]phenyl acetate
- IUPAC
- [4-(trifluoromethylsulfonyl)phenyl] acetate
Names & synonyms
4-[(TRIFLUOROMETHYL)SULFONYL]PHENYL ACETATE1193709-01-1SCHEMBL1886221DB-316068Phenol, 4-[(trifluoromethyl)sulfonyl]-, 1-acetate
Database identifiers
- PubChem CID
- 67200435
- Nikkaji
- J3.438.132A
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 374
Related reactions
2 records
Compound notes
Loading…