Basic information
- CAS
16526-90-2- Standard SMILES
C1CCC2CC2CC1- InChIKey
AKHMHYGTZRJYBS-UHFFFAOYSA-N- Molecular formula
- C8H14
- Average molar mass
- 110.2 g/mol
- Monoisotopic mass
- 110.10955045
Names & identifiers
- Preferred name
- Bicyclo[5.1.0]octane
- IUPAC
- bicyclo[5.1.0]octane
- English name
- Bicyclo[5.1.0]octane
- Molecular formula
- C8H14
- Molecular weight
- 110.2
Names & synonyms
Bicyclo[5.1.0]octaneBicyclo(5.1.0)octane286-43-1SCHEMBL69826SCHEMBL914963SCHEMBL11337950DTXSID50937054AKHMHYGTZRJYBS-UHFFFAOYSA-N
Database identifiers
- CAS
16526-90-2、286-43-1- PubChem CID
- 136123
- DTXSID
DTXSID50937054- Nikkaji
- J43.484A
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 76
Physicochemical properties
- Boiling point
- 143 °C · 143 °C
- Density
- 0.896 · 0.896±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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