3H-Purine, 3-(acetyloxy)-
TL;DR: 3H-Purine, 3-(acetyloxy)- (CAS 52212-82-5) is a chemical compound with molecular formula C7H6N4O2 and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
purin-3-yl acetate
Also Known As: purin-3-yl acetate, 3-(Acetyloxy)-3H-purine, 3H-Purine, 3-(acetyloxy)-, 3H-Purin-3-yl acetate
| Molecular Formula | C7H6N4O2 |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.04907 |
| Heavy Atoms | 13 |
| Complexity | 211.0 |
Chemical Identifiers
| CAS Number | 52212-82-5 |
|---|---|
| SMILES | CC(=O)ON1C=NC=C2C1=NC=N2 |
| InChIKey | MAZSZEKQYSKGLV-UHFFFAOYSA-N |
Product Overview
3H-Purine, 3-(acetyloxy)- (CAS 52212-82-5), with molecular formula C7H6N4O2 and molecular weight 178.05 g/mol. IUPAC: purin-3-yl acetate.
Chemical Property Profile of 3H-Purine, 3-(acetyloxy)-
Property Insights of 3H-Purine, 3-(acetyloxy)-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Purine, 3-(acetyloxy)-. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3H-Purine, 3-(acetyloxy)-. Following Lipinski's Rule of Five, 3H-Purine, 3-(acetyloxy)- has 0 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 3H-Purine, 3-(acetyloxy)-?
The CAS number of 3H-Purine, 3-(acetyloxy)- is 52212-82-5.
What is the molecular formula of 3H-Purine, 3-(acetyloxy)-?
The molecular formula of 3H-Purine, 3-(acetyloxy)- is C7H6N4O2.
What is the molecular weight of 3H-Purine, 3-(acetyloxy)-?
The molecular weight of 3H-Purine, 3-(acetyloxy)- is 178.05 g/mol.
Where can I buy 3H-Purine, 3-(acetyloxy)-?
You can request a quote for 3H-Purine, 3-(acetyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Purine, 3-(acetyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Purine, 3-(acetyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.