Tricetylmonium chloride
TL;DR: Tricetylmonium chloride (CAS 52467-63-7) is a chemical compound with molecular formula C49H102ClN and molecular weight 739.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trihexadecyl(methyl)azanium chloride
Also Known As: Tricetylmonium chloride, Tricetylmethylammonium chloride, ARQUAD PC 316, trihexadecyl(methyl)azanium;chloride, N,N-dihexadecyl-N-methylhexadecan-1-aminium chloride
| Molecular Formula | C49H102ClN |
|---|---|
| Molecular Weight | 739.77 g/mol |
| LogP | 14.88 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 45 |
| Exact Mass | 739.7701 |
| Heavy Atoms | 51 |
| Complexity | 505.0 |
Chemical Identifiers
| CAS Number | 52467-63-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Cl-] |
| InChIKey | FAGMGMRSURYROS-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tricetylmonium chloride (CAS 52467-63-7), with molecular formula C49H102ClN and molecular weight 739.77 g/mol. IUPAC: trihexadecyl(methyl)azanium chloride.
Chemical Property Profile of Tricetylmonium chloride
Property Insights of Tricetylmonium chloride
The XLogP value of 14.88 indicates that Tricetylmonium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Tricetylmonium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tricetylmonium chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tricetylmonium chloride?
The CAS number of Tricetylmonium chloride is 52467-63-7.
What is the molecular formula of Tricetylmonium chloride?
The molecular formula of Tricetylmonium chloride is C49H102ClN.
What is the molecular weight of Tricetylmonium chloride?
The molecular weight of Tricetylmonium chloride is 739.77 g/mol.
Where can I buy Tricetylmonium chloride?
You can request a quote for Tricetylmonium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tricetylmonium chloride?
Yes, KEHONG BIO provides custom synthesis services for Tricetylmonium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.