Basic information
- CAS
22668-10-6- Standard SMILES
CC1OOC1(C)C- InChIKey
WYCJJXMCBWIUOK-UHFFFAOYSA-N- Molecular formula
- C5H10O2
- Average molar mass
- 102.13 g/mol
- Monoisotopic mass
- 102.06807956
Names & identifiers
- Preferred name
- 3,3,4-Trimethyl-1,2-dioxetane
- IUPAC
- 3,3,4-trimethyldioxetane
Names & synonyms
22668-10-63,3,4-Trimethyl-1,2-dioxetaneTRMDtrimethyl dioxetane1,2-Dioxetane, 3,3,4-trimethyl-SCHEMBL76180233,3,4-trimethyl-[1,2]dioxetaneNSC146393NSC 146393NSC-146393
Database identifiers
- CAS
22668-10-6- PubChem CID
- 98929
- Nikkaji
- J536.426D
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 78.1
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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