Basic information
- CAS
33976-40-8- Standard SMILES
O=S1(=O)CCS(=O)(=O)CC1- InChIKey
NAGDZPOXYGPVIF-UHFFFAOYSA-N- Molecular formula
- C4H8O4S2
- Average molar mass
- 184.2 g/mol
- Monoisotopic mass
- 183.98640108
Names & identifiers
- Preferred name
- 1,4-Dithiane 1,1,4,4-tetraoxide
- IUPAC
- 1,4-dithiane 1,1,4,4-tetraoxide
Names & synonyms
1,4-dithiane 1,1,4,4-tetraoxide33976-40-8DTXSID30299788RefChem:220842DTXCID60250923NSC132865SCHEMBL256063NSC-1328651lambda~6~,4lambda~6~-Dithiane-1,1,4,4-tetrone
Database identifiers
- CAS
33976-40-8- PubChem CID
- 280736
- DTXSID
DTXSID30299788
Properties
Computed structural properties
- XLogP
- -1.2
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 244
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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