2-Chloro-4-(chlorocarbonyl)phenyl 4-methylbenzene-1-sulfonate
Basic information
- CAS
77823-34-8- Standard SMILES
Cc1ccc(S(=O)(=O)Oc2ccc(C(=O)Cl)cc2Cl)cc1- InChIKey
SYCASMDHJNOQMP-UHFFFAOYSA-N- Molecular formula
- C14H10Cl2O4S
- Average molar mass
- 345.2 g/mol
- Monoisotopic mass
- 343.9676854
Names & identifiers
- Preferred name
- 2-Chloro-4-(chlorocarbonyl)phenyl 4-methylbenzene-1-sulfonate
- IUPAC
- (4-carbonochloridoyl-2-chlorophenyl) 4-methylbenzenesulfonate
Names & synonyms
77823-34-8DTXSID005156842-Chloro-4-(chlorocarbonyl)phenyl 4-methylbenzene-1-sulfonate
Database identifiers
- CAS
77823-34-8- PubChem CID
- 13029366
- DTXSID
DTXSID00515684
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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