2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
TL;DR: 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine (CAS 28820-59-9) is a chemical compound with molecular formula C9H6F3N9O15 and molecular weight 536.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
Also Known As: 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine, RefChem:245903
| Molecular Formula | C9H6F3N9O15 |
|---|---|
| Molecular Weight | 536.99 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 341.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 9 |
| Exact Mass | 536.9935 |
| Heavy Atoms | 36 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 28820-59-9 |
|---|---|
| SMILES | C(C([N+](=O)[O-])([N+](=O)[O-])F)OC1=NC(=NC(=N1)OCC([N+](=O)[O-])([N+](=O)[O-])F)OCC([N+](=O)[O-])([N+](=O)[O-])F |
| InChIKey | GJYPVHOKDDJFAH-UHFFFAOYSA-N |
Product Overview
2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine (CAS 28820-59-9), with molecular formula C9H6F3N9O15 and molecular weight 536.99 g/mol. IUPAC: 2,4,6-tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine.
Chemical Property Profile of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
Property Insights of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine. The TPSA of 341.0 Ų indicates high polarity, suggesting 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine has 0 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The CAS number of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is 28820-59-9.
What is the molecular formula of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The molecular formula of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is C9H6F3N9O15.
What is the molecular weight of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
The molecular weight of 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine is 536.99 g/mol.
Where can I buy 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
You can request a quote for 2,4,6-Tris(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 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tris(2-fluoro-2,2-dinitroethoxy)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.