(2-(p-Toloxy)ethyl)trimethylammonium bromide
TL;DR: (2-(p-Toloxy)ethyl)trimethylammonium bromide (CAS 6974-08-9) is a chemical compound with molecular formula C12H20BrNO and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-[2-(4-methylphenoxy)ethyl]azanium bromide
Also Known As: choline p-tolyl ether bromide, beta-(p-Toloxy)ethyltrimethylammonium bromide, (2-(p-Toloxy)ethyl)trimethylammonium bromide, AMMONIUM, (2-(p-TOLYLOXY)ETHYL)TRIMETHYL-, BROMIDE, TRIMETHYL(2-P-TOLYLOXYETHYL)AMMONIUM BROMIDE
| Molecular Formula | C12H20BrNO |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | -0.92 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.0728 |
| Heavy Atoms | 15 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 6974-08-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)OCC[N+](C)(C)C.[Br-] |
| InChIKey | APXGBKBMFMHJET-UHFFFAOYSA-M |
Product Overview
(2-(p-Toloxy)ethyl)trimethylammonium bromide (CAS 6974-08-9), with molecular formula C12H20BrNO and molecular weight 273.07 g/mol. IUPAC: trimethyl-[2-(4-methylphenoxy)ethyl]azanium bromide.
Chemical Property Profile of (2-(p-Toloxy)ethyl)trimethylammonium bromide
Property Insights of (2-(p-Toloxy)ethyl)trimethylammonium bromide
The XLogP value of -0.92 indicates that (2-(p-Toloxy)ethyl)trimethylammonium bromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 9.2 Ų, (2-(p-Toloxy)ethyl)trimethylammonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-(p-Toloxy)ethyl)trimethylammonium bromide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2-(p-Toloxy)ethyl)trimethylammonium bromide?
The CAS number of (2-(p-Toloxy)ethyl)trimethylammonium bromide is 6974-08-9.
What is the molecular formula of (2-(p-Toloxy)ethyl)trimethylammonium bromide?
The molecular formula of (2-(p-Toloxy)ethyl)trimethylammonium bromide is C12H20BrNO.
What is the molecular weight of (2-(p-Toloxy)ethyl)trimethylammonium bromide?
The molecular weight of (2-(p-Toloxy)ethyl)trimethylammonium bromide is 273.07 g/mol.
Where can I buy (2-(p-Toloxy)ethyl)trimethylammonium bromide?
You can request a quote for (2-(p-Toloxy)ethyl)trimethylammonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-(p-Toloxy)ethyl)trimethylammonium bromide?
Yes, KEHONG BIO provides custom synthesis services for (2-(p-Toloxy)ethyl)trimethylammonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.