2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione
TL;DR: 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione (CAS 76-78-8) is a chemical compound with molecular formula C22H28O6 and molecular weight 388.1886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,15-dimethoxy-2,6,14,17-tetramethyl-10-oxatetracyclo[7.7.1.02,7.013,17]heptadeca-4,14-diene-3,11,16-trione
Also Known As: quassin, Nigakilactone D, Isoquassin, Picrasmin, (+)-Isoquassin
Technical Specifications
| Molecular Formula | C22H28O6 |
| Molecular Weight | 388.1886 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 388.1886 Da |
| Heavy Atoms | 28 |
| Complexity | 838.0 |
| Melting Point | 221 - 222 °C |
| SMILES | CC1C=C(C(=O)C2(C1CC3C4(C2C(=O)C(=C(C4CC(=O)O3)C)OC)C)C)OC |
| InChIKey | IOSXSVZRTUWBHC-UHFFFAOYSA-N |
Product Description
Applications: 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione is used in organic synthesis 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 fine chemical supplied by CoreyChem, 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione (CAS 76-78-8) has the molecular formula C22H28O6 and a molecular weight of 388.19 g/mol. Synonyms include quassin and Nigakilactone D.
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 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione
Property Insights of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione. Following Lipinski's Rule of Five, 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
The CAS number of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione is 76-78-8.
What is the molecular formula of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
The molecular formula of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione is C22H28O6.
What is the molecular weight of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
The molecular weight of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione is 388.1886 g/mol.
What are the applications of 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione is used in organic synthesis 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...
Where can I buy 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
You can request a quote for 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione?
Yes, CoreyChem provides custom synthesis services for 2,12-Dimethoxypicrasa-2,12-diene-1,11,16-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.