Podophyllotoxin
TL;DR: Podophyllotoxin (CAS 518-28-5) is a chemical compound with molecular formula C22H22O8 and molecular weight 414.13147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5R,5aR,8aR,9R)-5-hydroxy-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-8-one
Also Known As: podophyllotoxin, Podofilox, Condylox, Condyline, Wartec
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C22H22O8 |
| Molecular Weight | 414.13147 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 92.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 414.13147 Da |
| Heavy Atoms | 30 |
| Complexity | 629.0 |
| Melting Point | 228 |
| Vapor Pressure | 8.3X10-15 mm Hg at 25 °C /Estimated/ |
| Solubility | 100 |
| SMILES | COC1=CC(=CC(=C1OC)OC)[C@H]2[C@@H]3[C@H](COC3=O)[C@H](C4=CC5=C(C=C24)OCO5)O |
| InChIKey | YJGVMLPVUAXIQN-XVVDYKMHSA-N |
Product Description
Applications: Podophyllotoxin 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 Podophyllotoxin (CAS 518-28-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Podophyllotoxin (CAS 518-28-5) is a pharmaceutical intermediate with the molecular formula C22H22O8 and a molecular weight of 414.13 g/mol. Key physical properties include a solubility: 100. It is also known as podophyllotoxin and Podofilox.
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 Podophyllotoxin
Property Insights of Podophyllotoxin
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Podophyllotoxin. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Podophyllotoxin. Following Lipinski's Rule of Five, Podophyllotoxin has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Podophyllotoxin?
The CAS number of Podophyllotoxin is 518-28-5.
What is the molecular formula of Podophyllotoxin?
The molecular formula of Podophyllotoxin is C22H22O8.
What is the molecular weight of Podophyllotoxin?
The molecular weight of Podophyllotoxin is 414.13147 g/mol.
What are the applications of Podophyllotoxin?
Podophyllotoxin 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 Podophyllotoxin (CAS 518-28-5) with...
Where can I buy Podophyllotoxin?
You can request a quote for Podophyllotoxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Podophyllotoxin?
Yes, CoreyChem provides custom synthesis services for Podophyllotoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.