Basic information
- Standard SMILES
CS(=O)(=O)NCCOS(=O)(=O)c1ccc(Cl)cc1- InChIKey
QNDDPVSDHCLQRH-UHFFFAOYSA-N- Molecular formula
- C9H12ClNO5S2
- Average molar mass
- 313.8 g/mol
Names & identifiers
- Preferred name
- 2-Methanesulfonylaminoethyl-4-chlorobenzenesulfonate
- IUPAC
- 2-(methanesulfonamido)ethyl 4-chlorobenzenesulfonate
Names & synonyms
QNDDPVSDHCLQRH-UHFFFAOYSA-N2-methanesulfonylaminoethyl-4-chlorobenzenesulfonate
Database identifiers
- PubChem CID
- 20141389
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 442
Related reactions
1 records
Compound notes
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