N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium
TL;DR: N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium (CAS 84454-87-5) is a chemical compound with molecular formula C40H78BrNO4 and molecular weight 715.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-hexadecanoyloxyethyl)-methyl-prop-2-enylazanium bromide
Also Known As: Abhema, N-allylbis(2- methylammonium, N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium, bis(2-hexadecanoyloxyethyl)-methyl-prop-2-enylazanium;bromide, N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium bromide
| Molecular Formula | C40H78BrNO4 |
|---|---|
| Molecular Weight | 715.51 g/mol |
| LogP | 8.672 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 38 |
| Exact Mass | 715.5114 |
| Heavy Atoms | 46 |
| Complexity | 617.0 |
Chemical Identifiers
| CAS Number | 84454-87-5 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC[N+](C)(CCOC(=O)CCCCCCCCCCCCCCC)CC=C.[Br-] |
| InChIKey | NUWYFAYDFUREIT-UHFFFAOYSA-M |
Product Overview
N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium (CAS 84454-87-5), with molecular formula C40H78BrNO4 and molecular weight 715.51 g/mol. IUPAC: bis(2-hexadecanoyloxyethyl)-methyl-prop-2-enylazanium bromide.
Chemical Property Profile of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium
Property Insights of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium
The XLogP value of 8.672 indicates that N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium?
The CAS number of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium is 84454-87-5.
What is the molecular formula of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium?
The molecular formula of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium is C40H78BrNO4.
What is the molecular weight of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium?
The molecular weight of N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium is 715.51 g/mol.
Where can I buy N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium?
You can request a quote for N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium?
Yes, KEHONG BIO provides custom synthesis services for N-Allylbis(2-(hexadecanoyloxy)ethyl)methylammonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.