8,9,13-Trihydroxydocosanoic acid
TL;DR: 8,9,13-Trihydroxydocosanoic acid (CAS 23066-89-9) is a chemical compound with molecular formula C22H44O5 and molecular weight 388.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9,13-trihydroxydocosanoic acid
Also Known As: 8,9,13-Trihydroxydocosanoic acid, 8,9,13-Thda, 8,9,13-trihydroxydocosanoicacid, 8,9,13-trihy-droxydocosanoic acid, Docosanoic acid,8,9,13-trihydroxy
| Molecular Formula | C22H44O5 |
|---|---|
| Molecular Weight | 388.32 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 388.31888 |
| Heavy Atoms | 27 |
| Complexity | 335.0 |
Chemical Identifiers
| CAS Number | 23066-89-9 |
|---|---|
| SMILES | CCCCCCCCCC(CCCC(C(CCCCCCC(=O)O)O)O)O |
| InChIKey | JHAAEJPYWGVVFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8,9,13-Trihydroxydocosanoic acid (CAS 23066-89-9), with molecular formula C22H44O5 and molecular weight 388.32 g/mol. IUPAC: 8,9,13-trihydroxydocosanoic acid.
Chemical Property Profile of 8,9,13-Trihydroxydocosanoic acid
Property Insights of 8,9,13-Trihydroxydocosanoic acid
The XLogP value of 5.6 indicates that 8,9,13-Trihydroxydocosanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8,9,13-Trihydroxydocosanoic acid. Following Lipinski's Rule of Five, 8,9,13-Trihydroxydocosanoic acid has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8,9,13-Trihydroxydocosanoic acid?
The CAS number of 8,9,13-Trihydroxydocosanoic acid is 23066-89-9.
What is the molecular formula of 8,9,13-Trihydroxydocosanoic acid?
The molecular formula of 8,9,13-Trihydroxydocosanoic acid is C22H44O5.
What is the molecular weight of 8,9,13-Trihydroxydocosanoic acid?
The molecular weight of 8,9,13-Trihydroxydocosanoic acid is 388.32 g/mol.
Where can I buy 8,9,13-Trihydroxydocosanoic acid?
You can request a quote for 8,9,13-Trihydroxydocosanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8,9,13-Trihydroxydocosanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 8,9,13-Trihydroxydocosanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.