1-Fluorobicyclo(2.2.2)octane
TL;DR: 1-Fluorobicyclo(2.2.2)octane (CAS 20277-22-9) is a chemical compound with molecular formula C8H13F and molecular weight 128.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluorobicyclo[2.2.2]octane
Also Known As: 1-Fluorobicyclo[2.2.2]octane, bicyclo[2.2.2]octane, 1-fluoro-, 4-fluorobicyclo[2.2.2]octane, 1-Fluorobicyclo(2.2.2)octane, bicyclo[2.2.2]oct-1-ylfluoride
| Molecular Formula | C8H13F |
|---|---|
| Molecular Weight | 128.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.10013 |
| Heavy Atoms | 9 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 20277-22-9 |
|---|---|
| SMILES | C1CC2(CCC1CC2)F |
| InChIKey | HAQDPSRBYOWAEI-UHFFFAOYSA-N |
Product Overview
1-Fluorobicyclo(2.2.2)octane (CAS 20277-22-9), with molecular formula C8H13F and molecular weight 128.10 g/mol. IUPAC: 1-fluorobicyclo[2.2.2]octane.
Chemical Property Profile of 1-Fluorobicyclo(2.2.2)octane
Property Insights of 1-Fluorobicyclo(2.2.2)octane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Fluorobicyclo(2.2.2)octane. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Fluorobicyclo(2.2.2)octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluorobicyclo(2.2.2)octane has 0 hydrogen bond donor(s) and 1 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 1-Fluorobicyclo(2.2.2)octane?
The CAS number of 1-Fluorobicyclo(2.2.2)octane is 20277-22-9.
What is the molecular formula of 1-Fluorobicyclo(2.2.2)octane?
The molecular formula of 1-Fluorobicyclo(2.2.2)octane is C8H13F.
What is the molecular weight of 1-Fluorobicyclo(2.2.2)octane?
The molecular weight of 1-Fluorobicyclo(2.2.2)octane is 128.10 g/mol.
Where can I buy 1-Fluorobicyclo(2.2.2)octane?
You can request a quote for 1-Fluorobicyclo(2.2.2)octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluorobicyclo(2.2.2)octane?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluorobicyclo(2.2.2)octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.