Guanine, 3-hydroxy-1-methyl-, acetate
TL;DR: Guanine, 3-hydroxy-1-methyl-, acetate (CAS 52212-83-6) is a chemical compound with molecular formula C8H9N5O3 and molecular weight 223.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-imino-1-methyl-6-oxo-7H-purin-3-yl) acetate
Also Known As: 3-Acetoxy-1-methylguanine, Guanine, 3-hydroxy-1-methyl-, acetate, (2-imino-1-methyl-6-oxo-7H-purin-3-yl) acetate, 6H-Purin-6-one, 3-(acetyloxy)-1,2,3,7-tetrahydro-2-imino-1-methyl-
| Molecular Formula | C8H9N5O3 |
|---|---|
| Molecular Weight | 223.07 g/mol |
| LogP | -1.48233 |
| Topological Polar Surface Area | 105.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.07054 |
| Heavy Atoms | 16 |
| Complexity | 677.0191 |
Chemical Identifiers
| CAS Number | 52212-83-6 |
|---|---|
| SMILES | CC(=O)ON1C2=C(C(=O)N(C1=N)C)NC=N2 |
Product Overview
Guanine, 3-hydroxy-1-methyl-, acetate (CAS 52212-83-6), with molecular formula C8H9N5O3 and molecular weight 223.07 g/mol. IUPAC: (2-imino-1-methyl-6-oxo-7H-purin-3-yl) acetate.
Chemical Property Profile of Guanine, 3-hydroxy-1-methyl-, acetate
Property Insights of Guanine, 3-hydroxy-1-methyl-, acetate
The XLogP value of -1.48233 indicates that Guanine, 3-hydroxy-1-methyl-, acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 105.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Guanine, 3-hydroxy-1-methyl-, acetate. Following Lipinski's Rule of Five, Guanine, 3-hydroxy-1-methyl-, acetate has 2 hydrogen bond donor(s) and 5 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 Guanine, 3-hydroxy-1-methyl-, acetate?
The CAS number of Guanine, 3-hydroxy-1-methyl-, acetate is 52212-83-6.
What is the molecular formula of Guanine, 3-hydroxy-1-methyl-, acetate?
The molecular formula of Guanine, 3-hydroxy-1-methyl-, acetate is C8H9N5O3.
What is the molecular weight of Guanine, 3-hydroxy-1-methyl-, acetate?
The molecular weight of Guanine, 3-hydroxy-1-methyl-, acetate is 223.07 g/mol.
Where can I buy Guanine, 3-hydroxy-1-methyl-, acetate?
You can request a quote for Guanine, 3-hydroxy-1-methyl-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Guanine, 3-hydroxy-1-methyl-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Guanine, 3-hydroxy-1-methyl-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.