9-甲基尿酸
TL;DR: 9-甲基尿酸 (CAS 55441-71-9) is a chemical compound with molecular formula C6H6N4O3 and molecular weight 182.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-甲基尿酸
9-methyl-3,7-dihydropurine-2,6,8-trione
Also Known As: 9-Methyluric acid, 9-METHYL URIC ACID, 9-Methylharnsaure, N9-methyluric acid, 9-METHYLURICACID
| Molecular Formula | C6H6N4O3 |
|---|---|
| Molecular Weight | 182.04 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 90.5 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 182.04399 |
| Heavy Atoms | 13 |
| Complexity | 359.0 |
| Solubility | 0.021 mg/mL at 25 °C |
Chemical Identifiers
| CAS Number | 55441-71-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)NC(=O)N2)NC1=O |
| InChIKey | XJEJWDFDVPDMAS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9-甲基尿酸 (CAS 55441-71-9), with molecular formula C6H6N4O3 and molecular weight 182.04 g/mol. IUPAC: 9-methyl-3,7-dihydropurine-2,6,8-trione.
Chemical Property Profile of 9-甲基尿酸
Property Insights of 9-甲基尿酸
The XLogP value of -1.1 indicates that 9-甲基尿酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 90.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-甲基尿酸. Following Lipinski's Rule of Five, 9-甲基尿酸 has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-甲基尿酸?
The CAS number of 9-甲基尿酸 is 55441-71-9.
What is the molecular formula of 9-甲基尿酸?
The molecular formula of 9-甲基尿酸 is C6H6N4O3.
What is the molecular weight of 9-甲基尿酸?
The molecular weight of 9-甲基尿酸 is 182.04 g/mol.
Where can I buy 9-甲基尿酸?
You can request a quote for 9-甲基尿酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-甲基尿酸?
Yes, KEHONG BIO provides custom synthesis services for 9-甲基尿酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.