Trimethyl(2-Phenoxyethyl)Azanium
TL;DR: Trimethyl(2-Phenoxyethyl)Azanium (CAS 6779-86-8) is a chemical compound with molecular formula C11H18NO+ and molecular weight 180.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl(2-phenoxyethyl)azanium
Also Known As: trimethyl(2-phenoxyethyl)azanium, N,N,N-trimethyl-2-phenoxyethanaminium, Ethanaminium,N,N,N-trimethyl-2-phenoxy, Ethanaminium, N,N,N-trimethyl-2-phenoxy-, N,N,N-Trimethyl-2-phenoxyethan-1-aminium
| Molecular Formula | C11H18NO+ |
|---|---|
| Molecular Weight | 180.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.13884 |
| Heavy Atoms | 13 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 6779-86-8 |
|---|---|
| SMILES | C[N+](C)(C)CCOC1=CC=CC=C1 |
| InChIKey | VCXBSHBJVUIQHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trimethyl(2-Phenoxyethyl)Azanium (CAS 6779-86-8), with molecular formula C11H18NO+ and molecular weight 180.14 g/mol. IUPAC: trimethyl(2-phenoxyethyl)azanium.
Chemical Property Profile of Trimethyl(2-Phenoxyethyl)Azanium
Property Insights of Trimethyl(2-Phenoxyethyl)Azanium
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trimethyl(2-Phenoxyethyl)Azanium. With a topological polar surface area (TPSA) of 9.2 Ų, Trimethyl(2-Phenoxyethyl)Azanium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trimethyl(2-Phenoxyethyl)Azanium has 0 hydrogen bond donor(s) and 1 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 Trimethyl(2-Phenoxyethyl)Azanium?
The CAS number of Trimethyl(2-Phenoxyethyl)Azanium is 6779-86-8.
What is the molecular formula of Trimethyl(2-Phenoxyethyl)Azanium?
The molecular formula of Trimethyl(2-Phenoxyethyl)Azanium is C11H18NO+.
What is the molecular weight of Trimethyl(2-Phenoxyethyl)Azanium?
The molecular weight of Trimethyl(2-Phenoxyethyl)Azanium is 180.14 g/mol.
Where can I buy Trimethyl(2-Phenoxyethyl)Azanium?
You can request a quote for Trimethyl(2-Phenoxyethyl)Azanium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trimethyl(2-Phenoxyethyl)Azanium?
Yes, KEHONG BIO provides custom synthesis services for Trimethyl(2-Phenoxyethyl)Azanium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.