Basic information
- CAS
284-22-0- Standard SMILES
C1CCC2OOC(C1)O2- InChIKey
HTGOQTRDXNHQJI-UHFFFAOYSA-N- Molecular formula
- C6H10O3
- Average molar mass
- 130.14 g/mol
- Monoisotopic mass
- 130.06299418
Names & identifiers
- Preferred name
- 7,8,9-Trioxabicyclo[4.2.1]nonane
- IUPAC
- 7,8,9-trioxabicyclo[4.2.1]nonane
Names & synonyms
7,8,9-Trioxabicyclo[4.2.1]nonane284-22-07,8,9-Trioxabicyclo(4.2.1)nonaneDTXSID609510697,8,9-trioxabicyclo-[4.2.1]nonane
Database identifiers
- CAS
284-22-0- PubChem CID
- 136120
- DTXSID
DTXSID60951069- Nikkaji
- J1.036.430B
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 92.5
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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