Basic information
- Standard SMILES
CN1C(=O)CCC1(O)c1ccc(Cl)c(S(=O)(=O)Cl)c1- InChIKey
TVMXGEYQUAIOKH-UHFFFAOYSA-N- Molecular formula
- C11H11Cl2NO4S
- Average molar mass
- 324.2 g/mol
Names & identifiers
- Preferred name
- 5-(4-Chloro-3-chlorosulfonylphenyl)-5-hydroxy-1-methyl-2-pyrrolidone
- IUPAC
- 2-chloro-5-(2-hydroxy-1-methyl-5-oxopyrrolidin-2-yl)benzenesulfonyl chloride
Names & synonyms
SCHEMBL10400111TVMXGEYQUAIOKH-UHFFFAOYSA-NEN300-373782705-(4-chloro-3-chlorosulfonylphenyl)-5-hydroxy-1-methyl-2-oxo-pyrrolidine5-(4-Chloro-3-chlorosulfonylphenyl)-5-hydroxy-1-methyl-2-pyrrolidone2-chloro-5-(2-hydroxy-1-methyl-5-oxopyrrolidin-2-yl)benzene-1-sulfonyl chloride79822-24-5
Database identifiers
- PubChem CID
- 14256804
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 83.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 478
Related reactions
8 records
Compound notes
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