Allantoin
TL;DR: Allantoin (CAS 97-59-6) is a chemical compound with molecular formula C4H6N4O3 and molecular weight 158.04399 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2,5-dioxoimidazolidin-4-yl)urea
Also Known As: allantoin, 5-Ureidohydantoin, Glyoxyldiureide, Cordianine, Glyoxyldiureid
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6N4O3 |
| Molecular Weight | 158.04399 g/mol |
| XLogP | -2.2 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 158.04399 Da |
| Heavy Atoms | 11 |
| Complexity | 225.0 |
| Melting Point | 239 °C /Racemic form/ |
| Solubility | Soluble in alcohol, methanol, pyridine |
| SMILES | C1(C(=O)NC(=O)N1)NC(=O)N |
| InChIKey | POJWUDADGALRAB-UHFFFAOYSA-N |
Product Description
Applications: Allantoin is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Allantoin (CAS 97-59-6) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, Allantoin (CAS 97-59-6) has the molecular formula C4H6N4O3 and a molecular weight of 158.04 g/mol. Reported properties include a solubility: Soluble in alcohol, methanol, pyridine. It is also known as allantoin and 5-Ureidohydantoin.
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 Allantoin
Property Insights of Allantoin
The XLogP value of -2.2 indicates that Allantoin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Allantoin. Following Lipinski's Rule of Five, Allantoin has 4 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Allantoin?
The CAS number of Allantoin is 97-59-6.
What is the molecular formula of Allantoin?
The molecular formula of Allantoin is C4H6N4O3.
What is the molecular weight of Allantoin?
The molecular weight of Allantoin is 158.04399 g/mol.
What are the applications of Allantoin?
Allantoin is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Allantoin (CAS 97-59-6) with custom synthesis available from milligram...
Where can I buy Allantoin?
You can request a quote for Allantoin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Allantoin?
Yes, CoreyChem provides custom synthesis services for Allantoin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.