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2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium structure
Fine Chemical

2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium

TL;DR: 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium (CAS 21306-56-9) is a chemical compound with molecular formula C16H27N2O+ and molecular weight 263.21234 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-(2,6-dimethylanilino)-2-oxoethyl]-triethylazanium

Also Known As: QX 314 bromide, QX 314, Lidocaine N-ethyl bromide, Lopac-L-5783, UPCMLD-DP014

CAS Number
21306-56-9
Molecular Formula
C16H27N2O+
Molecular Weight
263.21234 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (10 patents)

Technical Specifications

Molecular FormulaC16H27N2O+
Molecular Weight263.21234 g/mol
XLogP2.5
Topological Polar Surface Area (TPSA)29.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds6
Exact Mass263.21234 Da
Heavy Atoms19
Complexity268.0
SMILESCC[N+](CC)(CC)CC(=O)NC1=C(C=CC=C1C)C
InChIKeyPYEBKOFMWAMBFV-UHFFFAOYSA-O

Product Description

Applications: 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A pharmaceutical intermediate supplied by CoreyChem, 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium (CAS 21306-56-9) has the molecular formula C16H27N2O+ and a molecular weight of 263.21 g/mol. Synonyms include QX-314 and QX 314 bromide.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium

XLogP
2.5
TPSA (Topological Polar Surface Area)
29.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
6
Heavy Atoms
19
Complexity
268.0
Exact Mass
263.21234
Monoisotopic Mass
263.21234
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium

The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium. With a topological polar surface area (TPSA) of 29.1 Ų, 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

The CAS number of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium is 21306-56-9.

What is the molecular formula of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

The molecular formula of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium is C16H27N2O+.

What is the molecular weight of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

The molecular weight of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium is 263.21234 g/mol.

What are the applications of 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with...

Where can I buy 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

You can request a quote for 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium?

Yes, CoreyChem provides custom synthesis services for 2-((2,6-Dimethylphenyl)amino)-N,N,N-triethyl-2-oxoethanaminium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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