2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
TL;DR: 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine (CAS 100508-57-4) is a chemical compound with molecular formula C8H7F2N7O11 and molecular weight 415.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-1,3,5-triazine
Also Known As: 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine, 2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-1,3,5-triazine, 1,3,5-Triazine, 2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-, 2,4-Dimethoxy-6-(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
| Molecular Formula | C8H7F2N7O11 |
|---|---|
| Molecular Weight | 415.02 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 250.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.01715 |
| Heavy Atoms | 28 |
| Complexity | 538.0 |
Chemical Identifiers
| CAS Number | 100508-57-4 |
|---|---|
| SMILES | COC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | MWDAMNNZTWJXEP-UHFFFAOYSA-N |
Product Overview
2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine (CAS 100508-57-4), with molecular formula C8H7F2N7O11 and molecular weight 415.02 g/mol. IUPAC: 2,4-bis(2-fluoro-2,2-dinitroethoxy)-6-methoxy-1,3,5-triazine.
Chemical Property Profile of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
Property Insights of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine. The TPSA of 250.0 Ų indicates high polarity, suggesting 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine has 0 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The CAS number of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is 100508-57-4.
What is the molecular formula of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The molecular formula of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is C8H7F2N7O11.
What is the molecular weight of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The molecular weight of 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is 415.02 g/mol.
Where can I buy 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
You can request a quote for 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-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-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-4,6-bis(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.