2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
TL;DR: 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine (CAS 28690-97-3) is a chemical compound with molecular formula C11H9ClN4O5 and molecular weight 312.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
Also Known As: 2-(4-chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine, 2-{4-chloro-2-nitrophenoxy}-4,6-dimethoxy-1,3,5-triazine, AL-398/12677071, 2-(4-chloro-2-nitro-phenoxy)-4,6-dimethoxy-[1,3,5]triazine, 4-(4-Chloro-2-nitrophenoxy)-2,6-dimethoxy-1,3,5-triazine
| Molecular Formula | C11H9ClN4O5 |
|---|---|
| Molecular Weight | 312.03 g/mol |
| LogP | 2.2427 |
| Topological Polar Surface Area | 109.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 312.02615 |
| Heavy Atoms | 21 |
| Complexity | 659.4083 |
Chemical Identifiers
| CAS Number | 28690-97-3 |
|---|---|
| SMILES | COC1=NC(=NC(=N1)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])OC |
Product Overview
2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine (CAS 28690-97-3), with molecular formula C11H9ClN4O5 and molecular weight 312.03 g/mol. IUPAC: 2-(4-chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine.
Chemical Property Profile of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
Property Insights of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
The XLogP value of 2.2427 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine. The TPSA of 109.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine. Following Lipinski's Rule of Five, 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine has 0 hydrogen bond donor(s) and 8 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 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The CAS number of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is 28690-97-3.
What is the molecular formula of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The molecular formula of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is C11H9ClN4O5.
What is the molecular weight of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The molecular weight of 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is 312.03 g/mol.
Where can I buy 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
You can request a quote for 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Chloro-2-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.