Allantoic acid
TL;DR: Allantoic acid (CAS 99-16-1) is a chemical compound with molecular formula C4H8N4O4 and molecular weight 176.05455 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,2-bis(carbamoylamino)acetic acid
Also Known As: Allantoic acid, Diureidoacetic acid, allantoate, Allantoicacid, diureidoacetate
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H8N4O4 |
| Molecular Weight | 176.05455 g/mol |
| XLogP | -2.6 |
| Topological Polar Surface Area (TPSA) | 148.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 176.05455 Da |
| Heavy Atoms | 12 |
| Complexity | 199.0 |
| Melting Point | 180 - 181 °C |
| SMILES | C(C(=O)O)(NC(=O)N)NC(=O)N |
| InChIKey | NUCLJNSWZCHRKL-UHFFFAOYSA-N |
Product Description
Applications: Allantoic acid 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Allantoic acid is a pharmaceutical intermediate identified by CAS number 99-16-1 and the molecular formula C4H8N4O4 and a molecular weight of 176.05 g/mol. Synonyms include Allantoic acid and Diureidoacetic 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 Allantoic acid
Property Insights of Allantoic acid
The XLogP value of -2.6 indicates that Allantoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 148.0 Ų indicates high polarity, suggesting Allantoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Allantoic acid has 5 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 Allantoic acid?
The CAS number of Allantoic acid is 99-16-1.
What is the molecular formula of Allantoic acid?
The molecular formula of Allantoic acid is C4H8N4O4.
What is the molecular weight of Allantoic acid?
The molecular weight of Allantoic acid is 176.05455 g/mol.
What are the applications of Allantoic acid?
Allantoic acid 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to...
Where can I buy Allantoic acid?
You can request a quote for Allantoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Allantoic acid?
Yes, CoreyChem provides custom synthesis services for Allantoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.