Basic information
- CAS
137720-39-9- Standard SMILES
CC12CCCC(OC1)O2- InChIKey
IWBJRASWKFJRHS-UHFFFAOYSA-N- Molecular formula
- C7H12O2
- Average molar mass
- 128.17 g/mol
- Monoisotopic mass
- 128.08372962
Names & identifiers
- Preferred name
- 1-Methyl-6,8-dioxabicyclo(3.2.1)octane
- IUPAC
- 1-methyl-6,8-dioxabicyclo[3.2.1]octane
Names & synonyms
1-Methyl-6,8-dioxabicyclo(3.2.1)octane137720-39-91-Methyl-6,8-dioxabicyclo[3.2.1]octane6,8-Dioxabicyclo(3.2.1)octane, 1-methyl-DTXSID90929877
Database identifiers
- CAS
137720-39-9- PubChem CID
- 178404
- DTXSID
DTXSID90929877
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 124
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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