Trimethylsulfonylmethane
Basic information
- CAS
4610-99-5- Standard SMILES
CS(=O)(=O)C(S(C)(=O)=O)S(C)(=O)=O- InChIKey
QYBXIUDBUIUBHS-UHFFFAOYSA-N- Molecular formula
- C4H10O6S3
- Average molar mass
- 250.3 g/mol
- Monoisotopic mass
- 249.96395156
Names & identifiers
- Preferred name
- Trimethylsulfonylmethane
- IUPAC
- tris(methylsulfonyl)methane
Names & synonyms
Trimethylsulfonylmethanetris(methylsulfonyl)methane4610-99-567294-81-9Tri(methylsulfonyl)methantris(methylsulphonyl)methaneSCHEMBL800271DTXSID001032244
Database identifiers
- CAS
4610-99-5、67294-81-9- PubChem CID
- 144231
- DTXSID
DTXSID001032244
Properties
Computed structural properties
- XLogP
- -1.4
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 385
Experimental & physicochemical properties
SpringerMaterials PropertiesCrystal structure
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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