1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane
TL;DR: 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane (CAS 7507-66-6) is a chemical compound with molecular formula C21H18N6O6 and molecular weight 450.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(4-nitrophenyl)-1,3,5-triazinane
Also Known As: 1,3,5-tris(4-nitrophenyl)-1,3,5-triazinane, J1.748.728K, Hexahydro-1,3,5-tris(4-nitrophenyl)-1,3,5-triazine, RefChem:217528
| Molecular Formula | C21H18N6O6 |
|---|---|
| Molecular Weight | 450.13 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 450.12878 |
| Heavy Atoms | 33 |
| Complexity | 592.0 |
Chemical Identifiers
| CAS Number | 7507-66-6 |
|---|---|
| SMILES | C1N(CN(CN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)[N+](=O)[O-] |
| InChIKey | YOQXJHPQCLZWKX-UHFFFAOYSA-N |
Product Overview
1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane (CAS 7507-66-6), with molecular formula C21H18N6O6 and molecular weight 450.13 g/mol. IUPAC: 1,3,5-tris(4-nitrophenyl)-1,3,5-triazinane.
Chemical Property Profile of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane
Property Insights of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane
The XLogP value of 5.2 indicates that 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 147.0 Ų indicates high polarity, suggesting 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane?
The CAS number of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane is 7507-66-6.
What is the molecular formula of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane?
The molecular formula of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane is C21H18N6O6.
What is the molecular weight of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane?
The molecular weight of 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane is 450.13 g/mol.
Where can I buy 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane?
You can request a quote for 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tris(4-nitrophenyl)-1,3,5-triazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.