Basic information
- CAS
312-65-2- Standard SMILES
O=S(=O)(OCCCl)c1ccc(F)cc1- InChIKey
OAXFFPTVLXBWHL-UHFFFAOYSA-N- Molecular formula
- C8H8ClFO3S
- Average molar mass
- 238.66 g/mol
- Monoisotopic mass
- 237.9866711
Names & identifiers
- Preferred name
- 2-Chloroethyl 4-fluorobenzenesulfonate
- IUPAC
- 2-chloroethyl 4-fluorobenzenesulfonate
Names & synonyms
NSC324057312-65-2CHEMBL17356DTXSID10318007NSC-3240572-Chloroethyl 4-fluorobenzene-1-sulfonateDS-007059BENZENESULFONIC ACID,4-FLUORO-, 2-CHLOROETHYL ESTER
Database identifiers
- CAS
312-65-2- PubChem CID
- 331503
- DTXSID
DTXSID10318007- ChEMBL
CHEMBL17356
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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