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Bicyclo[2.2.2]octane-1,4-diol
TL;DR: Bicyclo[2.2.2]octane-1,4-diol (CAS 1194-44-1) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bicyclo[2.2.2]octane-1,4-diol
Also Known As: Bicyclo[2.2.2]octane-1,4-diol, 1,4-Dihydroxybicyclo[2.2.2]octane, 1,4-bicyclo[2.2.2]octane diol, bicyclo[2.2.2]octane-1,3-diol, 1,4-Dihydroxybicyclo(2.2.2)octane
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 1194-44-1 |
|---|---|
| SMILES | C1CC2(CCC1(CC2)O)O |
| InChIKey | BHSZKPHKWKSMKX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[2.2.2]octane-1,4-diol (CAS 1194-44-1), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: bicyclo[2.2.2]octane-1,4-diol.
Chemical Property Profile of Bicyclo[2.2.2]octane-1,4-diol
Property Insights of Bicyclo[2.2.2]octane-1,4-diol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.2]octane-1,4-diol. With a topological polar surface area (TPSA) of 40.5 Ų, Bicyclo[2.2.2]octane-1,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.2]octane-1,4-diol has 2 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-1,4-diol?
The CAS number of Bicyclo[2.2.2]octane-1,4-diol is 1194-44-1.
What is the molecular formula of Bicyclo[2.2.2]octane-1,4-diol?
The molecular formula of Bicyclo[2.2.2]octane-1,4-diol is C8H14O2.
What is the molecular weight of Bicyclo[2.2.2]octane-1,4-diol?
The molecular weight of Bicyclo[2.2.2]octane-1,4-diol is 142.10 g/mol.
Where can I buy Bicyclo[2.2.2]octane-1,4-diol?
You can request a quote for Bicyclo[2.2.2]octane-1,4-diol 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-1,4-diol?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.2]octane-1,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.