甲基三辛基氯化铵
TL;DR: 甲基三辛基氯化铵 (CAS 5137-55-3) is a chemical compound with molecular formula C25H54ClN and molecular weight 403.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基三辛基氯化铵
methyl(trioctyl)azanium chloride
Also Known As: Methyltrioctylammonium chloride, Capriquat, Aliquat 336, TOMAC, Trioctylmethylammonium chloride
| Molecular Formula | C25H54ClN |
|---|---|
| Molecular Weight | 403.39 g/mol |
| LogP | 5.52 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 21 |
| Exact Mass | 403.39447 |
| Heavy Atoms | 27 |
| Complexity | 220.0 |
| Melting Point | -20 °C |
| Boiling Point | 225 °C @760 [mm Hg] |
| Density | 0.884 @25 °C |
Chemical Identifiers
| CAS Number | 5137-55-3 |
|---|---|
| SMILES | CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.[Cl-] |
| InChIKey | XKBGEWXEAPTVCK-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基三辛基氯化铵 (CAS 5137-55-3), with molecular formula C25H54ClN and molecular weight 403.39 g/mol. IUPAC: methyl(trioctyl)azanium chloride.
Chemical Property Profile of 甲基三辛基氯化铵
Property Insights of 甲基三辛基氯化铵
The XLogP value of 5.52 indicates that 甲基三辛基氯化铵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 甲基三辛基氯化铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基三辛基氯化铵 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 甲基三辛基氯化铵?
The CAS number of 甲基三辛基氯化铵 is 5137-55-3.
What is the molecular formula of 甲基三辛基氯化铵?
The molecular formula of 甲基三辛基氯化铵 is C25H54ClN.
What is the molecular weight of 甲基三辛基氯化铵?
The molecular weight of 甲基三辛基氯化铵 is 403.39 g/mol.
Where can I buy 甲基三辛基氯化铵?
You can request a quote for 甲基三辛基氯化铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基三辛基氯化铵?
Yes, KEHONG BIO provides custom synthesis services for 甲基三辛基氯化铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.