3-tert-butyl-2H-thiete 1,1-dioxide
Basic information
- CAS
25903-16-6- Standard SMILES
CC(C)(C)C1=CS(=O)(=O)C1- InChIKey
VTWAZRMOSZZGFW-UHFFFAOYSA-N- Molecular formula
- C7H12O2S
- Average molar mass
- 160.24 g/mol
- Monoisotopic mass
- 160.05580079
Names & identifiers
- Preferred name
- 3-tert-butyl-2H-thiete 1,1-dioxide
- IUPAC
- 3-tert-butyl-2H-thiete 1,1-dioxide
Names & synonyms
25903-16-63-tert-butyl-2H-thiete 1,1-dioxideNSC301417DTXSID30316247NSC-3014173-tert-Butyl-1lambda~6~-thiete-1,1(2H)-dione
Database identifiers
- CAS
25903-16-6- PubChem CID
- 327207
- DTXSID
DTXSID30316247
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 42.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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