Cyclocumarol
TL;DR: Cyclocumarol (CAS 518-20-7) is a chemical compound with molecular formula C20H18O4 and molecular weight 322.1205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-2-methyl-4-phenyl-3,4-dihydropyrano[3,2-c]chromen-5-one
Also Known As: Pyranocoumarin, Cyclocoumarol, CYCLOCUMAROL, Cumopyran, Methanopyranorin
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C20H18O4 |
| Molecular Weight | 322.1205 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 322.1205 Da |
| Heavy Atoms | 24 |
| Complexity | 534.0 |
| SMILES | CC1(CC(C2=C(O1)C3=CC=CC=C3OC2=O)C4=CC=CC=C4)OC |
| InChIKey | ZGFASEKBKWVCGP-UHFFFAOYSA-N |
Product Description
Applications: Cyclocumarol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Cyclocumarol (CAS 518-20-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Cyclocumarol is a pharmaceutical intermediate identified by CAS number 518-20-7 and the molecular formula C20H18O4 and a molecular weight of 322.12 g/mol. It is also known as Pyranocoumarin and Cyclocoumarol.
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 Cyclocumarol
Property Insights of Cyclocumarol
The XLogP value of 3.7 indicates that Cyclocumarol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, Cyclocumarol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclocumarol has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Cyclocumarol?
The CAS number of Cyclocumarol is 518-20-7.
What is the molecular formula of Cyclocumarol?
The molecular formula of Cyclocumarol is C20H18O4.
What is the molecular weight of Cyclocumarol?
The molecular weight of Cyclocumarol is 322.1205 g/mol.
What are the applications of Cyclocumarol?
Cyclocumarol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Cyclocumarol (CAS 518-20-7) with custom...
Where can I buy Cyclocumarol?
You can request a quote for Cyclocumarol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclocumarol?
Yes, CoreyChem provides custom synthesis services for Cyclocumarol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.