Carboxymethyl stearate
TL;DR: Carboxymethyl stearate (CAS 5767-84-0) is a chemical compound with molecular formula C20H38O4 and molecular weight 342.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-octadecanoyloxyacetic acid
Also Known As: Carboxymethyl stearate, (stearoyloxy)acetic acid, carboxymethylstearate, 2-octadecanoyloxyacetic acid, 2-(Octadecanoyloxy)acetic acid
| Molecular Formula | C20H38O4 |
|---|---|
| Molecular Weight | 342.28 g/mol |
| LogP | 8.1 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 19 |
| Exact Mass | 342.277 |
| Heavy Atoms | 24 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 5767-84-0 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OCC(=O)O |
| InChIKey | HWLBIEAKJSRKOD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Carboxymethyl stearate (CAS 5767-84-0), with molecular formula C20H38O4 and molecular weight 342.28 g/mol. IUPAC: 2-octadecanoyloxyacetic acid.
Chemical Property Profile of Carboxymethyl stearate
Property Insights of Carboxymethyl stearate
The XLogP value of 8.1 indicates that Carboxymethyl stearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Carboxymethyl stearate. Following Lipinski's Rule of Five, Carboxymethyl stearate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Carboxymethyl stearate?
The CAS number of Carboxymethyl stearate is 5767-84-0.
What is the molecular formula of Carboxymethyl stearate?
The molecular formula of Carboxymethyl stearate is C20H38O4.
What is the molecular weight of Carboxymethyl stearate?
The molecular weight of Carboxymethyl stearate is 342.28 g/mol.
Where can I buy Carboxymethyl stearate?
You can request a quote for Carboxymethyl stearate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carboxymethyl stearate?
Yes, KEHONG BIO provides custom synthesis services for Carboxymethyl stearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.