Basic information
- CAS
63702-82-9- Standard SMILES
CC(C)(C)C1(C(C)(C)C)SC1=O- InChIKey
CFPUWMGFCYFCTF-UHFFFAOYSA-N- Molecular formula
- C10H18OS
- Average molar mass
- 186.32 g/mol
- Monoisotopic mass
- 186.10783637
Names & identifiers
- Preferred name
- 3,3-Di-tert-butylthiiran-2-one
- IUPAC
- 3,3-ditert-butylthiiran-2-one
Names & synonyms
3,3-Di-tert-butylthiiran-2-one63702-82-9DTXSID60495559RefChem:270194DTXCID60446369
Database identifiers
- CAS
63702-82-9- PubChem CID
- 12382829
- DTXSID
DTXSID60495559- Nikkaji
- J2.541.775E
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 42.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 203
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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