Cycloundecanecarboxylic acid
TL;DR: Cycloundecanecarboxylic acid (CAS 831-67-4) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cycloundecanecarboxylic acid
Also Known As: Cycloundecanecarboxylic acid, Cycloundecanecarboxylicacid, cycloundecanecarboxylic, cycloundecancarbonsäure, 2-Cyano-N-(2,6-dimethyl-phenyl)-acetamide
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 831-67-4 |
|---|---|
| SMILES | C1CCCCCC(CCCC1)C(=O)O |
| InChIKey | BHECNPOVJVTHKS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cycloundecanecarboxylic acid (CAS 831-67-4), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: cycloundecanecarboxylic acid.
Chemical Property Profile of Cycloundecanecarboxylic acid
Property Insights of Cycloundecanecarboxylic acid
The XLogP value of 4.6 indicates that Cycloundecanecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Cycloundecanecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cycloundecanecarboxylic 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 Cycloundecanecarboxylic acid?
The CAS number of Cycloundecanecarboxylic acid is 831-67-4.
What is the molecular formula of Cycloundecanecarboxylic acid?
The molecular formula of Cycloundecanecarboxylic acid is C12H22O2.
What is the molecular weight of Cycloundecanecarboxylic acid?
The molecular weight of Cycloundecanecarboxylic acid is 198.16 g/mol.
Where can I buy Cycloundecanecarboxylic acid?
You can request a quote for Cycloundecanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cycloundecanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for Cycloundecanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.