Embelin
TL;DR: Embelin (CAS 550-24-3) is a chemical compound with molecular formula C17H26O4 and molecular weight 294.1831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dihydroxy-3-undecylcyclohexa-2,5-diene-1,4-dione
Also Known As: EMBELIN, Embelic acid, Emberine, 2,5-dihydroxy-3-undecylcyclohexa-2,5-diene-1,4-dione, Embeliaquinone
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H26O4 |
| Molecular Weight | 294.1831 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 294.1831 Da |
| Heavy Atoms | 21 |
| Complexity | 432.0 |
| SMILES | CCCCCCCCCCCC1=C(C(=O)C=C(C1=O)O)O |
| InChIKey | IRSFLDGTOHBADP-UHFFFAOYSA-N |
Product Description
Applications: Embelin 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).
A pharmaceutical intermediate supplied by CoreyChem, Embelin (CAS 550-24-3) has the molecular formula C17H26O4 and a molecular weight of 294.18 g/mol. Synonyms include EMBELIN and Embelic 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 Embelin
Property Insights of Embelin
The XLogP value of 5.4 indicates that Embelin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Embelin. Following Lipinski's Rule of Five, Embelin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Embelin?
The CAS number of Embelin is 550-24-3.
What is the molecular formula of Embelin?
The molecular formula of Embelin is C17H26O4.
What is the molecular weight of Embelin?
The molecular weight of Embelin is 294.1831 g/mol.
What are the applications of Embelin?
Embelin 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...
Where can I buy Embelin?
You can request a quote for Embelin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Embelin?
Yes, CoreyChem provides custom synthesis services for Embelin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.