Basic information
- CAS
68483-74-9- Standard SMILES
CS(=O)(=O)CSCCO- InChIKey
IHCZCIDTAQHMPU-UHFFFAOYSA-N- Molecular formula
- C4H10O3S2
- Average molar mass
- 170.3 g/mol
- Monoisotopic mass
- 170.00713652
Names & identifiers
- Preferred name
- 2-[[(Methylsulfonyl)methyl]thio]ethanol
- IUPAC
- 2-(methylsulfonylmethylsulfanyl)ethanol
Names & synonyms
68483-74-93,5-Dithiahexanol 5,5-dioxide2-[[(Methylsulfonyl)methyl]thio]ethanolSCHEMBL22686098IHCZCIDTAQHMPU-UHFFFAOYSA-NDTXSID6012805322-([(Methylsulfonyl)methyl]sulfanyl)ethanol #2-{[(Methanesulfonyl)methyl]sulfanyl}ethan-1-ol
Database identifiers
- CAS
68483-74-9- PubChem CID
- 548382
- DTXSID
DTXSID601280532- Nikkaji
- J526.405G
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 88.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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