![Bicyclo[4.1.1]oct-2-ene structure](/static/products/165/16544-26-6.png)
Bicyclo[4.1.1]oct-2-ene
TL;DR: Bicyclo[4.1.1]oct-2-ene (CAS 16544-26-6) is a chemical compound with molecular formula C8H12 and molecular weight 108.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[4.1.1]oct-2-ene
Also Known As: Bicyclo[4.1.1]oct-2-ene, bicyclo[4.1.1]oct-4-ene
| Molecular Formula | C8H12 |
|---|---|
| Molecular Weight | 108.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 108.0939 |
| Heavy Atoms | 8 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 16544-26-6 |
|---|---|
| SMILES | C1CC2CC(C2)C=C1 |
| InChIKey | JVCSOJVVTVMKAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[4.1.1]oct-2-ene (CAS 16544-26-6), with molecular formula C8H12 and molecular weight 108.09 g/mol. IUPAC: bicyclo[4.1.1]oct-2-ene.
Chemical Property Profile of Bicyclo[4.1.1]oct-2-ene
Property Insights of Bicyclo[4.1.1]oct-2-ene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[4.1.1]oct-2-ene. With a topological polar surface area (TPSA) of 0.0 Ų, Bicyclo[4.1.1]oct-2-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[4.1.1]oct-2-ene 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
Frequently Asked Questions
What is the CAS number of Bicyclo[4.1.1]oct-2-ene?
The CAS number of Bicyclo[4.1.1]oct-2-ene is 16544-26-6.
What is the molecular formula of Bicyclo[4.1.1]oct-2-ene?
The molecular formula of Bicyclo[4.1.1]oct-2-ene is C8H12.
What is the molecular weight of Bicyclo[4.1.1]oct-2-ene?
The molecular weight of Bicyclo[4.1.1]oct-2-ene is 108.09 g/mol.
Where can I buy Bicyclo[4.1.1]oct-2-ene?
You can request a quote for Bicyclo[4.1.1]oct-2-ene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[4.1.1]oct-2-ene?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[4.1.1]oct-2-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.