Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)
TL;DR: Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) (CAS 35206-70-3) is a chemical compound with molecular formula C18H34CuO4 and molecular weight 377.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
copper bis(3,5,5-trimethylhexanoate)
Also Known As: Copper isononanoate, Copper 3,5,5-trimethylhexanoate, Cupric 3,5,5-trimethylhexanoate, Copper bis(3,5,5-trimethylhexanoate), C9H18O2.1/2Cu
| Molecular Formula | C18H34CuO4 |
|---|---|
| Molecular Weight | 377.18 g/mol |
| LogP | 2.39 |
| Topological Polar Surface Area | 80.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 377.1753 |
| Heavy Atoms | 23 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 35206-70-3 |
|---|---|
| SMILES | CC(CC(=O)[O-])CC(C)(C)C.CC(CC(=O)[O-])CC(C)(C)C.[Cu+2] |
| InChIKey | KLKMXKACEROVRH-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) (CAS 35206-70-3), with molecular formula C18H34CuO4 and molecular weight 377.18 g/mol. IUPAC: copper bis(3,5,5-trimethylhexanoate).
Chemical Property Profile of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)
Property Insights of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)
The XLogP value of 2.39 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1). The TPSA of 80.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1). Following Lipinski's Rule of Five, Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) 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 Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)?
The CAS number of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) is 35206-70-3.
What is the molecular formula of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)?
The molecular formula of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) is C18H34CuO4.
What is the molecular weight of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)?
The molecular weight of Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) is 377.18 g/mol.
Where can I buy Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)?
You can request a quote for Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1)?
Yes, KEHONG BIO provides custom synthesis services for Hexanoic acid, 3,5,5-trimethyl-, copper(2+) salt (2:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.