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Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-
TL;DR: Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- (CAS 57346-06-2) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylbicyclo[2.2.2]octane-2-carboxylic acid
Also Known As: Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-, 3-methylbicyclo[2.2.2]octane-3-carboxylic acid, Bicyclo[2.2.2]octane-2-carboxylic acid,2-methyl, 2-METHYLBICYCLO[2.2.2]OCTANE-2-CARBOXYLIC ACID
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 57346-06-2 |
|---|---|
| SMILES | CC1(CC2CCC1CC2)C(=O)O |
| InChIKey | PMQBDCJPTMTZJH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- (CAS 57346-06-2), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 2-methylbicyclo[2.2.2]octane-2-carboxylic acid.
Chemical Property Profile of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-
Property Insights of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-. With a topological polar surface area (TPSA) of 37.3 Ų, Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- 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-2-carboxylic acid, 2-methyl-?
The CAS number of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- is 57346-06-2.
What is the molecular formula of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-?
The molecular formula of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- is C10H16O2.
What is the molecular weight of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-?
The molecular weight of Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- is 168.12 g/mol.
Where can I buy Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl-?
You can request a quote for Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- 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-2-carboxylic acid, 2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.2]octane-2-carboxylic acid, 2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.