1,3,5-Tris(trichloromethyl)-1,3,5-triazinane
TL;DR: 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane (CAS 30805-22-2) is a chemical compound with molecular formula C6H6Cl9N3 and molecular weight 434.78 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-tris(trichloromethyl)-1,3,5-triazinane
Also Known As: 1,3,5-tris(trichloromethyl)-1,3,5-triazinane, 1,3,5-tripropionyl-1,3,5-triazinane, J1.614.948I, 1,3,5-Tris(trichloromethyl)hexahydro-s-triazine, 1,3,5-Triazine,hexahydro-1,3,5-tris(trichloromethyl)-
| Molecular Formula | C6H6Cl9N3 |
|---|---|
| Molecular Weight | 434.78 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 9.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 438.76996 |
| Heavy Atoms | 18 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 30805-22-2 |
|---|---|
| SMILES | C1N(CN(CN1C(Cl)(Cl)Cl)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl |
| InChIKey | ZGJREYUOKJFGAP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,5-Tris(trichloromethyl)-1,3,5-triazinane (CAS 30805-22-2), with molecular formula C6H6Cl9N3 and molecular weight 434.78 g/mol. IUPAC: 1,3,5-tris(trichloromethyl)-1,3,5-triazinane.
Chemical Property Profile of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane
Property Insights of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane
The XLogP value of 6.2 indicates that 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.7 Ų, 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane has 0 hydrogen bond donor(s) and 3 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(trichloromethyl)-1,3,5-triazinane?
The CAS number of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane is 30805-22-2.
What is the molecular formula of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane?
The molecular formula of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane is C6H6Cl9N3.
What is the molecular weight of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane?
The molecular weight of 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane is 434.78 g/mol.
Where can I buy 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane?
You can request a quote for 1,3,5-Tris(trichloromethyl)-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(trichloromethyl)-1,3,5-triazinane?
Yes, KEHONG BIO provides custom synthesis services for 1,3,5-Tris(trichloromethyl)-1,3,5-triazinane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.