Basic information
- CAS
23379-03-5- Standard SMILES
O=C(Oc1ccc(S(=O)(=O)F)cc1Cl)C(Cl)(Cl)Cl- InChIKey
OCTQHHDGKHCYKV-UHFFFAOYSA-N- Molecular formula
- C8H3Cl4FO4S
- Average molar mass
- 356 g/mol
- Monoisotopic mass
- 353.849019
Names & identifiers
- Preferred name
- Benzenesulfonyl fluoride, 3-chloro-4-hydroxy-, trichloroacetate
- IUPAC
- (2-chloro-4-fluorosulfonylphenyl) 2,2,2-trichloroacetate
- English name
- Trichloroacetic acid 2-chloro-4-(fluorosulfonyl)phenyl ester
- Molecular formula
- C8H3Cl4FO4S
- Molecular weight
- 355.98
Names & synonyms
23379-03-5BRN 2883029Benzenesulfonyl fluoride, 3-chloro-4-hydroxy-, trichloroacetate3-Chloro-4-hydroxybenzenesulfonyl fluoride trichloroacetate3-Chloro-4-trichloroacetyloxybenzenesulfonyl fluorideDTXSID40177927RefChem:325633DTXCID001004182-chloro-4-(fluorosulfonyl)phenyl trichloroacetateTrichloroacetic acid 2-chloro-4-(fluorosulfonyl)phenyl esterAcetic acid, 2,2,2-trichloro-, 2-chloro-4-(fluorosulfonyl)phenyl ester
Database identifiers
- CAS
23379-03-5- PubChem CID
- 211575
- DTXSID
DTXSID40177927- Nikkaji
- J41.346A
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 416
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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