2-(1,1-Dimethylethyl)-3-methyloxetane
Basic information
- CAS
7045-82-1- Standard SMILES
CC1COC1C(C)(C)C- InChIKey
YZUOZLHQBCFIKB-UHFFFAOYSA-N- Molecular formula
- C8H16O
- Average molar mass
- 128.21 g/mol
- Monoisotopic mass
- 128.12011513
Names & identifiers
- Preferred name
- 2-(1,1-Dimethylethyl)-3-methyloxetane
- IUPAC
- 2-tert-butyl-3-methyloxetane
Names & synonyms
7045-82-12-(1,1-Dimethylethyl)-3-methyloxetaneRefChem:2495742-tert-Butyl-3-methyloxetaneOxetane, 2-(1,1-dimethylethyl)-3-methyl-2-t-butyl-3-methyl oxetanSCHEMBL254469022-tert-Butyl-3-methyloxetane #YZUOZLHQBCFIKB-UHFFFAOYSA-NDTXSID201287043
Database identifiers
- CAS
7045-82-1- PubChem CID
- 534669
- DTXSID
DTXSID201287043
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 102
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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