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Bicyclo[2.2.2]octane, 1-methoxy-
TL;DR: Bicyclo[2.2.2]octane, 1-methoxy- (CAS 7697-14-5) is a chemical compound with molecular formula C9H16O and molecular weight 140.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxybicyclo[2.2.2]octane
Also Known As: 1-methoxybicyclo[2.2.2]octane, 4-methoxybicyclo[2.2.2]octane, Bicyclo(2.2.2)octane, 1-methoxy-, Bicyclo[2.2.2]octane,1-methoxy-, Bicyclo[2.2.2]octane, 1-methoxy-
| Molecular Formula | C9H16O |
|---|---|
| Molecular Weight | 140.12 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.12012 |
| Heavy Atoms | 10 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 7697-14-5 |
|---|---|
| SMILES | COC12CCC(CC1)CC2 |
| InChIKey | RIYARDQGQOVCPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[2.2.2]octane, 1-methoxy- (CAS 7697-14-5), with molecular formula C9H16O and molecular weight 140.12 g/mol. IUPAC: 1-methoxybicyclo[2.2.2]octane.
Chemical Property Profile of Bicyclo[2.2.2]octane, 1-methoxy-
Property Insights of Bicyclo[2.2.2]octane, 1-methoxy-
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.2]octane, 1-methoxy-. With a topological polar surface area (TPSA) of 9.2 Ų, Bicyclo[2.2.2]octane, 1-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.2]octane, 1-methoxy- 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 Bicyclo[2.2.2]octane, 1-methoxy-?
The CAS number of Bicyclo[2.2.2]octane, 1-methoxy- is 7697-14-5.
What is the molecular formula of Bicyclo[2.2.2]octane, 1-methoxy-?
The molecular formula of Bicyclo[2.2.2]octane, 1-methoxy- is C9H16O.
What is the molecular weight of Bicyclo[2.2.2]octane, 1-methoxy-?
The molecular weight of Bicyclo[2.2.2]octane, 1-methoxy- is 140.12 g/mol.
Where can I buy Bicyclo[2.2.2]octane, 1-methoxy-?
You can request a quote for Bicyclo[2.2.2]octane, 1-methoxy- 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-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.2]octane, 1-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.