Basic information
- CAS
4379-03-7- Standard SMILES
CC1CC(C)(C)S(=O)(=O)O1- InChIKey
CWWSIJWEKCSVRO-UHFFFAOYSA-N- Molecular formula
- C6H12O3S
- Average molar mass
- 164.22 g/mol
- Monoisotopic mass
- 164.05071541
Names & identifiers
- Preferred name
- 3,3,5-Trimethyl-1,2-oxathiolane 2,2-dioxide
- IUPAC
- 3,3,5-trimethyloxathiolane 2,2-dioxide
Names & synonyms
3,3,5-Trimethyl-1,2-oxathiolane 2,2-dioxide4379-03-7NSC82166NSC 821663,3,5-trimethyloxathiolane 2,2-dioxideNCIOpen2_000961SCHEMBL4417245NSC23362NSC-23362NSC-82166NSC101355NSC-101355
Database identifiers
- CAS
4379-03-7- PubChem CID
- 229583
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 51.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 222
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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