9,12-Octadecadiynoic acid
TL;DR: 9,12-Octadecadiynoic acid (CAS 2012-14-8) is a chemical compound with molecular formula C18H28O2 and molecular weight 276.20892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
octadeca-9,12-diynoic acid
Also Known As: 9,12-octadecadiynoic acid, octadeca-9,12-diynoic acid, ODYA, 9a-12a-Octadecadiynoic acid, 9,12-Octadecadiynoicacid
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H28O2 |
| Molecular Weight | 276.20892 g/mol |
| XLogP | 6.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 276.20892 Da |
| Heavy Atoms | 20 |
| Complexity | 369.0 |
| SMILES | CCCCCC#CCC#CCCCCCCCC(=O)O |
| InChIKey | KDYILQLPKVZDGB-UHFFFAOYSA-N |
Product Description
Applications: 9,12-Octadecadiynoic acid is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. 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).
9,12-Octadecadiynoic acid is a pharmaceutical intermediate identified by CAS number 2012-14-8 and the molecular formula C18H28O2 and a molecular weight of 276.21 g/mol. Synonyms include 9,12-octadecadiynoic acid and octadeca-9,12-diynoic 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 9,12-Octadecadiynoic acid
Property Insights of 9,12-Octadecadiynoic acid
The XLogP value of 6.3 indicates that 9,12-Octadecadiynoic 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, 9,12-Octadecadiynoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9,12-Octadecadiynoic 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 9,12-Octadecadiynoic acid?
The CAS number of 9,12-Octadecadiynoic acid is 2012-14-8.
What is the molecular formula of 9,12-Octadecadiynoic acid?
The molecular formula of 9,12-Octadecadiynoic acid is C18H28O2.
What is the molecular weight of 9,12-Octadecadiynoic acid?
The molecular weight of 9,12-Octadecadiynoic acid is 276.20892 g/mol.
What are the applications of 9,12-Octadecadiynoic acid?
9,12-Octadecadiynoic acid is used in pharmaceutical synthesis routes and API production, as well as complex organic molecule assembly across discovery and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 9,12-Octadecadiynoic acid?
You can request a quote for 9,12-Octadecadiynoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9,12-Octadecadiynoic acid?
Yes, CoreyChem provides custom synthesis services for 9,12-Octadecadiynoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.