Basic information
- Standard SMILES
CC(=O)Cc1ccc(Cl)c(S(=O)(=O)NCCO)c1- InChIKey
KXKSACUBQANSKK-UHFFFAOYSA-N- Molecular formula
- C11H14ClNO4S
- Average molar mass
- 291.75 g/mol
- Monoisotopic mass
- 291.0332068
Names & identifiers
- Preferred name
- 2-Chloro-N-(2-hydroxy-ethyl)-5-(2-oxo-propyl)-benzenesulfonamide
- IUPAC
- 2-chloro-N-(2-hydroxyethyl)-5-(2-oxopropyl)benzenesulfonamide
Names & synonyms
SCHEMBL2394622KXKSACUBQANSKK-UHFFFAOYSA-N2-Chloro-N-(2-hydroxy-ethyl)-5-(2-oxo-propyl)-benzenesulfonamide
Database identifiers
- PubChem CID
- 67390996
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 91.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 379
Related reactions
5 records
Compound notes
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