2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
TL;DR: 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine (CAS 163685-01-6) is a chemical compound with molecular formula C11H9ClN4O5 and molecular weight 312.02615 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
Also Known As: 2-(3-chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine, 2-{3-chloro-4-nitrophenoxy}-4,6-dimethoxy-1,3,5-triazine, AL-398/12677059, 2-(4-Nitro-3-chlorophenoxy)-4,6-dimethoxy-1,3,5-triazine
Technical Specifications
| Molecular Formula | C11H9ClN4O5 |
| Molecular Weight | 312.02615 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 312.02615 Da |
| Heavy Atoms | 21 |
| Complexity | 346.0 |
| SMILES | COC1=NC(=NC(=N1)OC2=CC(=C(C=C2)[N+](=O)[O-])Cl)OC |
| InChIKey | ZRSTTYFRZMZZMS-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
Property Insights of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine
The XLogP value of 3.0 indicates that 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine. Following Lipinski's Rule of Five, 2-(3-Chloro-4-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
What is the CAS number of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The CAS number of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is 163685-01-6.
What is the molecular formula of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The molecular formula of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is C11H9ClN4O5.
What is the molecular weight of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
The molecular weight of 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine is 312.02615 g/mol.
Where can I buy 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
You can request a quote for 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine?
Yes, CoreyChem provides custom synthesis services for 2-(3-Chloro-4-nitrophenoxy)-4,6-dimethoxy-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.