Basic information
- CAS
13952-54-0- Standard SMILES
CN(C)S(=O)(=O)c1ccc(CCc2ccc(Cl)cc2)cc1- InChIKey
CJYAFQSTPINODA-UHFFFAOYSA-N- Molecular formula
- C16H18ClNO2S
- Average molar mass
- 323.8 g/mol
- Monoisotopic mass
- 323.0746777
Names & identifiers
- Preferred name
- 4-[2-(4-chlorophenyl)ethyl]-N,N-dimethylbenzenesulfonamide
- IUPAC
- 4-[2-(4-chlorophenyl)ethyl]-N,N-dimethylbenzenesulfonamide
Names & synonyms
13952-54-0NSC106059DTXSID40930498NSC-106059DS-0069964-[2-(4-Chlorophenyl)ethyl]-N,N-dimethylbenzene-1-sulfonamideBENZENESULFONAMIDE,4-[2-(4-CHLOROPHENYL)ETHYL]-N,N-DIMETHYL-
Database identifiers
- CAS
13952-54-0- PubChem CID
- 266972
- DTXSID
DTXSID40930498
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 402
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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