2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt
TL;DR: 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt (CAS 66375-37-9) is a chemical compound with molecular formula C21H34K2O4 and molecular weight 428.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dipotassium;5-(7-carboxylatoheptyl)-2-hexylcyclohex-3-ene-1-carboxylate
Also Known As: Potassium cyclocarboxypropyloleate, 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt, 2-Cyclohexene-1-octanoic acid, 5(or 6)-carboxy-4-hexyl-, dipotassium salt, 3-Hexyl-4-carboxy-6-(8-octanoic)cyclohexene-1-2, dipotassium salt, Dipotassium 5-carboxylato-4-hexylcyclohex-2-ene-1-octanoate
| Molecular Formula | C21H34K2O4 |
|---|---|
| Molecular Weight | 428.17 g/mol |
| LogP | -3.0 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 428.17313 |
| Heavy Atoms | 27 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 66375-37-9 |
|---|---|
| SMILES | CCCCCCC1C=CC(CC1C(=O)[O-])CCCCCCCC(=O)[O-].[K+].[K+] |
| InChIKey | WEHLQEBKDGJWEI-UHFFFAOYSA-L |
Product Overview
2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt (CAS 66375-37-9), with molecular formula C21H34K2O4 and molecular weight 428.17 g/mol. IUPAC: dipotassium;5-(7-carboxylatoheptyl)-2-hexylcyclohex-3-ene-1-carboxylate.
Chemical Property Profile of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt
Property Insights of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt
The XLogP value of -3.0 indicates that 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt. Following Lipinski's Rule of Five, 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt has 0 hydrogen bond donor(s) and 4 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 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt?
The CAS number of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt is 66375-37-9.
What is the molecular formula of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt?
The molecular formula of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt is C21H34K2O4.
What is the molecular weight of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt?
The molecular weight of 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt is 428.17 g/mol.
Where can I buy 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt?
You can request a quote for 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyclohexene-1-octanoic acid, 5-carboxy-4-hexyl-, dipotassium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.