![Bicyclo[2.2.2]octane-1-carboxylic acid structure](/static/products/6995/699-55-8.webp)
Bicyclo[2.2.2]octane-1-carboxylic acid
TL;DR: Bicyclo[2.2.2]octane-1-carboxylic acid (CAS 699-55-8) is a chemical compound with molecular formula C1CC2(CCC1CC2)C(=O)O and molecular weight 154.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[2.2.2]octane-1-carboxylic acid
Also Known As: Bicyclo[2.2.2]octane-1-carboxylic acid, Bicyclo(2.2.2)octane-1-carboxylic acid, bicyclo[2.2.2]octane-4-carboxylic acid, bicyclo[2.2.2]octane-1-carboxylic, Bicyclo[2.2.2]octane-1-carboxylicacid
| Molecular Formula | C1CC2(CCC1CC2)C(=O)O |
|---|---|
| Molecular Weight | 154.10 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.09938 |
| Heavy Atoms | 11 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 699-55-8 |
|---|---|
| SMILES | C1CC2(CCC1CC2)C(=O)O |
| InChIKey | PUNFICOCZAPAJV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[2.2.2]octane-1-carboxylic acid (CAS 699-55-8), with molecular formula C1CC2(CCC1CC2)C(=O)O and molecular weight 154.10 g/mol. IUPAC: bicyclo[2.2.2]octane-1-carboxylic acid.
Chemical Property Profile of Bicyclo[2.2.2]octane-1-carboxylic acid
Property Insights of Bicyclo[2.2.2]octane-1-carboxylic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.2]octane-1-carboxylic acid. With a topological polar surface area (TPSA) of 37.3 Ų, Bicyclo[2.2.2]octane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.2]octane-1-carboxylic acid has 1 hydrogen bond donor(s) and 2 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[2.2.2]octane-1-carboxylic acid?
The CAS number of Bicyclo[2.2.2]octane-1-carboxylic acid is 699-55-8.
What is the molecular formula of Bicyclo[2.2.2]octane-1-carboxylic acid?
The molecular formula of Bicyclo[2.2.2]octane-1-carboxylic acid is C1CC2(CCC1CC2)C(=O)O.
What is the molecular weight of Bicyclo[2.2.2]octane-1-carboxylic acid?
The molecular weight of Bicyclo[2.2.2]octane-1-carboxylic acid is 154.10 g/mol.
Where can I buy Bicyclo[2.2.2]octane-1-carboxylic acid?
You can request a quote for Bicyclo[2.2.2]octane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[2.2.2]octane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.2]octane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.