Basic information
- CAS
106562-31-6- Standard SMILES
CC(C)C1CC2C=CC1CC2- InChIKey
MWCYZAVQYCJVIJ-UHFFFAOYSA-N- Molecular formula
- C11H18
- Average molar mass
- 150.26 g/mol
- Monoisotopic mass
- 150.14085057
Names & identifiers
- Preferred name
- 5-Propan-2-ylbicyclo[2.2.2]oct-2-ene
- IUPAC
- 5-propan-2-ylbicyclo[2.2.2]oct-2-ene
- English name
- Bicyclo[2.2.2]oct-2-ene, 5-(1-methylethyl)-, (1alpha,4alpha,5ba)- (9CI)
- Molecular formula
- C11H18
- Molecular weight
- 150.26
Names & synonyms
5-propan-2-ylbicyclo[2.2.2]oct-2-ene106562-31-6106623-87-4Bicyclo[2.2.2]oct-2-ene, 5-(1-methylethyl)-, (1alpha,4alpha,5ba)- (9CI)Bicyclo(2.2.2)oct-2-ene, 5-(1-methylethyl)-, (1alpha,4alpha,5beta)-DTXSID00910034Bicyclo(2.2.2)oct-2-ene, 5-(1-methylethyl)-, (1alpha,4alpha,5alpha)-5-(Propan-2-yl)bicyclo[2.2.2]oct-2-eneBicyclo[2.2.2]oct-2-ene, 5-(1-methylethyl)-, (1.alpha.,4.alpha.,5.beta.)-bicyclo[2.2.2]oct-2-ene,5-(1-methylethyl)-,(1.alpha.,4.alpha.,5.alpha.)-Bicyclo[2.2.2]oct-2-ene, 5-(1-methylethyl)-, (1R,4R,5S)-rel-Bicyclo[2.2.2]oct-2-ene, 5-(1-methylethyl)-, (1alpha,4alpha,5b
Show more names
Bicyclo[2.2.2]oct-2-ene,5-(1-methylethyl)-,(1alpha,4alpha,5bta)-(9CI)
Database identifiers
- CAS
106562-31-6、106623-87-4- PubChem CID
- 145441
- DTXSID
DTXSID00910034
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 167
Physicochemical properties
- Boiling point
- 192.4 · 192.4±7.0 °C(Predicted)
- Density
- 0.892 · 0.892±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
CHEMSTEP[email protected]
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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