Basic information
- CAS
5456-60-0- Standard SMILES
OC1C2CCCC1COC2- InChIKey
XTYFHQIXFUBAIG-UHFFFAOYSA-N- Molecular formula
- C8H14O2
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.09937969
Names & identifiers
- Preferred name
- 3-Oxabicyclo[3.3.1]nonan-9-ol
- IUPAC
- 3-oxabicyclo[3.3.1]nonan-9-ol
Names & synonyms
3-oxabicyclo[3.3.1]nonan-9-ol5456-60-0NSC21544DTXSID102814047-oxabicyclo[3.3.1]nonan-9-olNSC-21544
Database identifiers
- CAS
5456-60-0- PubChem CID
- 228552
- DTXSID
DTXSID10281404
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 112
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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