Bicyclo(2.2.2)octane
TL;DR: Bicyclo(2.2.2)octane (CAS 280-33-1) is a chemical compound with molecular formula C8H14 and molecular weight 110.10955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bicyclo[2.2.2]octane
Also Known As: Bicyclo[2.2.2]octane, 1,4-Endoethylenecyclohexane, BICYCLO(2.2.2)OCTANE, bicyclo[2,2,2]octane, 1-FLUORO-3-NITROBENZENE
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H14 |
| Molecular Weight | 110.10955 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.10955 Da |
| Heavy Atoms | 8 |
| Complexity | 55.0 |
| SMILES | C1CC2CCC1CC2 |
| InChIKey | GPRLTFBKWDERLU-UHFFFAOYSA-N |
Product Description
Applications: Bicyclo(2.2.2)octane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bicyclo(2.2.2)octane (CAS 280-33-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Bicyclo(2.2.2)octane (CAS 280-33-1) is a heterocyclic building block with the molecular formula C8H14 and a molecular weight of 110.11 g/mol. It is also known as Bicyclo[2.2.2]octane and 1,4-Endoethylenecyclohexane.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bicyclo(2.2.2)octane
Property Insights of Bicyclo(2.2.2)octane
The XLogP value of 3.5 indicates that Bicyclo(2.2.2)octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo(2.2.2)octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(2.2.2)octane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Bicyclo(2.2.2)octane?
The CAS number of Bicyclo(2.2.2)octane is 280-33-1.
What is the molecular formula of Bicyclo(2.2.2)octane?
The molecular formula of Bicyclo(2.2.2)octane is C8H14.
What is the molecular weight of Bicyclo(2.2.2)octane?
The molecular weight of Bicyclo(2.2.2)octane is 110.10955 g/mol.
What are the applications of Bicyclo(2.2.2)octane?
Bicyclo(2.2.2)octane is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Bicyclo(2.2.2)octane (CAS...
Where can I buy Bicyclo(2.2.2)octane?
You can request a quote for Bicyclo(2.2.2)octane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bicyclo(2.2.2)octane?
Yes, CoreyChem provides custom synthesis services for Bicyclo(2.2.2)octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.