2,8-Dihydroxyadenine
TL;DR: 2,8-Dihydroxyadenine (CAS 30377-37-8) is a chemical compound with molecular formula C5H5N5O2 and molecular weight 167.04433 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-7,9-dihydro-1H-purine-2,8-dione
Also Known As: 2,8-Dihydroxyadenine, 6-Amino-1H-purine-2,8(3H,7H)-dione, 2,8-Dioxyadenine, dimethyloctanoate, Dimethyloctanoic acid
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H5N5O2 |
| Molecular Weight | 167.04433 g/mol |
| XLogP | -1.9 |
| Topological Polar Surface Area (TPSA) | 109.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.04433 Da |
| Heavy Atoms | 12 |
| Complexity | 342.0 |
| Solubility | 0.002 mg/mL |
| SMILES | C12=C(NC(=O)N=C1NC(=O)N2)N |
| InChIKey | XFBOJHLYDJZYSP-UHFFFAOYSA-N |
Chemical Property Profile of 2,8-Dihydroxyadenine
Property Insights of 2,8-Dihydroxyadenine
The XLogP value of -1.9 indicates that 2,8-Dihydroxyadenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,8-Dihydroxyadenine. Following Lipinski's Rule of Five, 2,8-Dihydroxyadenine 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 2,8-Dihydroxyadenine?
The CAS number of 2,8-Dihydroxyadenine is 30377-37-8.
What is the molecular formula of 2,8-Dihydroxyadenine?
The molecular formula of 2,8-Dihydroxyadenine is C5H5N5O2.
What is the molecular weight of 2,8-Dihydroxyadenine?
The molecular weight of 2,8-Dihydroxyadenine is 167.04433 g/mol.
Where can I buy 2,8-Dihydroxyadenine?
You can request a quote for 2,8-Dihydroxyadenine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,8-Dihydroxyadenine?
Yes, CoreyChem provides custom synthesis services for 2,8-Dihydroxyadenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.