Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)OCCS(C)(=O)=O)cc1- InChIKey
FFWASDWPUAKZQI-UHFFFAOYSA-N- Molecular formula
- C10H14O5S2
- Average molar mass
- 278.3 g/mol
Names & identifiers
- Preferred name
- 2-(Methylsulfonyl)ethyl 4-methylbenzenesulfonate
- IUPAC
- 2-methylsulfonylethyl 4-methylbenzenesulfonate
Names & synonyms
103275-86-12-(methylsulfonyl)ethyl 4-methylbenzenesulfonate1-[(2-methanesulfonylethoxy)sulfonyl]-4-methylbenzeneNSC140193SCHEMBL1556981FFWASDWPUAKZQI-UHFFFAOYSA-NNSC-140193DB-098227EN300-6995857toluene-4-sulfonic acid 2-methanesulfonyl-ethyl ester
Database identifiers
- PubChem CID
- 284378
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 94.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 418
Related reactions
4 records
Compound notes
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