Basic information
- CAS
5684-31-1- Standard SMILES
CC1(C)OCCS1- InChIKey
XLSCZCCJPDTCGU-UHFFFAOYSA-N- Molecular formula
- C5H10OS
- Average molar mass
- 118.2 g/mol
- Monoisotopic mass
- 118.04523611
Names & identifiers
- Preferred name
- 2,2-Dimethyl-1,3-oxathiolane
- IUPAC
- 2,2-dimethyl-1,3-oxathiolane
Names & synonyms
2,2-Dimethyl-1,3-oxathiolane1,3-OXATHIOLANE, 2,2-DIMETHYL-5684-31-1NSC 203379BRN 0102790I3E25G1WO7NSC-203379UNII-I3E25G1WO7DTXSID202053735-19-01-00062 (Beilstein Handbook Reference)RefChem:81036DTXCID20127864
Show more names
XLSCZCCJPDTCGU-UHFFFAOYSA-N2,3-oxathiolaneNSC203379SCHEMBL7382285SCHEMBL7382291WLN: T5O CS BHJ B1 B1
Database identifiers
- CAS
5684-31-1- PubChem CID
- 21886
- DTXSID
DTXSID20205373- UNII
- I3E25G1WO7
- Nikkaji
- J42.599K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 34.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 70.5
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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