13-Docosenoic acid
TL;DR: 13-Docosenoic acid (CAS 112-86-7) is a chemical compound with molecular formula C22H42O2 and molecular weight 338.31848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
docos-13-enoic acid
Also Known As: ERUCIC ACID, 13-Docosenoic acid, docos-13-enoic acid, Brassidic acid, Erucic acid 98%
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H42O2 |
| Molecular Weight | 338.31848 g/mol |
| XLogP | 8.7 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 19 |
| Exact Mass | 338.31848 Da |
| Heavy Atoms | 24 |
| Complexity | 284.0 |
| SMILES | CCCCCCCCC=CCCCCCCCCCCCC(=O)O |
| InChIKey | DPUOLQHDNGRHBS-UHFFFAOYSA-N |
Product Description
Applications: 13-Docosenoic acid is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
13-Docosenoic acid (CAS 112-86-7) is a pharmaceutical intermediate with the molecular formula C22H42O2 and a molecular weight of 338.32 g/mol. Synonyms include ERUCIC ACID and 13-Docosenoic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 13-Docosenoic acid
Property Insights of 13-Docosenoic acid
The XLogP value of 8.7 indicates that 13-Docosenoic 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, 13-Docosenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13-Docosenoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 13-Docosenoic acid?
The CAS number of 13-Docosenoic acid is 112-86-7.
What is the molecular formula of 13-Docosenoic acid?
The molecular formula of 13-Docosenoic acid is C22H42O2.
What is the molecular weight of 13-Docosenoic acid?
The molecular weight of 13-Docosenoic acid is 338.31848 g/mol.
What are the applications of 13-Docosenoic acid?
13-Docosenoic acid is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project...
Where can I buy 13-Docosenoic acid?
You can request a quote for 13-Docosenoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 13-Docosenoic acid?
Yes, CoreyChem provides custom synthesis services for 13-Docosenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.