6-Chloro2-nitropurine
TL;DR: 6-Chloro2-nitropurine (CAS 713498-01-2) is a chemical compound with molecular formula C5H2ClN5O2 and molecular weight 198.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-2-nitro-7H-purine
Also Known As: 2-nitro-6-chloropurine, 6-chloro2-nitropurine, 6-chloro-2-nitro-7H-purine
| Molecular Formula | C5H2ClN5O2 |
|---|---|
| Molecular Weight | 198.99 g/mol |
| LogP | 0.9145 |
| Topological Polar Surface Area | 97.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.9897 |
| Heavy Atoms | 13 |
| Complexity | 480.72952 |
Chemical Identifiers
| CAS Number | 713498-01-2 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=NC(=N2)[N+](=O)[O-])Cl |
Product Overview
6-Chloro2-nitropurine (CAS 713498-01-2), with molecular formula C5H2ClN5O2 and molecular weight 198.99 g/mol. IUPAC: 6-chloro-2-nitro-7H-purine.
Chemical Property Profile of 6-Chloro2-nitropurine
Property Insights of 6-Chloro2-nitropurine
The XLogP value of 0.9145 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro2-nitropurine. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro2-nitropurine. Following Lipinski's Rule of Five, 6-Chloro2-nitropurine has 1 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 6-Chloro2-nitropurine?
The CAS number of 6-Chloro2-nitropurine is 713498-01-2.
What is the molecular formula of 6-Chloro2-nitropurine?
The molecular formula of 6-Chloro2-nitropurine is C5H2ClN5O2.
What is the molecular weight of 6-Chloro2-nitropurine?
The molecular weight of 6-Chloro2-nitropurine is 198.99 g/mol.
Where can I buy 6-Chloro2-nitropurine?
You can request a quote for 6-Chloro2-nitropurine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro2-nitropurine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro2-nitropurine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.