2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine
TL;DR: 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine (CAS 916-85-8) is a chemical compound with molecular formula C27H54N3O9P3 and molecular weight 657.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-tris(dibutoxyphosphoryl)-1,3,5-triazine
Also Known As: 2,4,6-tris(dibutoxyphosphoryl)-1,3,5-triazine, 2,4,6-Tri(dibutoxyphosphinyl)-1,3,5-triazine, Hexabutyl 1,3,5-triazine-2,4,6-triyltris(phosphonate), dibutyl [4,6-bis(dibutoxyphosphoryl)-1,3,5-triazin-2-yl]phosphonate
| Molecular Formula | C27H54N3O9P3 |
|---|---|
| Molecular Weight | 657.31 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 145.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 27 |
| Exact Mass | 657.3073 |
| Heavy Atoms | 42 |
| Complexity | 681.0 |
Chemical Identifiers
| CAS Number | 916-85-8 |
|---|---|
| SMILES | CCCCOP(=O)(C1=NC(=NC(=N1)P(=O)(OCCCC)OCCCC)P(=O)(OCCCC)OCCCC)OCCCC |
| InChIKey | LMTGTGUCWYSKRC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine (CAS 916-85-8), with molecular formula C27H54N3O9P3 and molecular weight 657.31 g/mol. IUPAC: 2,4,6-tris(dibutoxyphosphoryl)-1,3,5-triazine.
Chemical Property Profile of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine
Property Insights of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine
The XLogP value of 5.8 indicates that 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 145.0 Ų indicates high polarity, suggesting 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine has 0 hydrogen bond donor(s) and 12 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(dibutoxyphosphoryl)-1,3,5-triazine?
The CAS number of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine is 916-85-8.
What is the molecular formula of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine?
The molecular formula of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine is C27H54N3O9P3.
What is the molecular weight of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine?
The molecular weight of 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine is 657.31 g/mol.
Where can I buy 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine?
You can request a quote for 2,4,6-Tris(dibutoxyphosphoryl)-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(dibutoxyphosphoryl)-1,3,5-triazine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Tris(dibutoxyphosphoryl)-1,3,5-triazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.