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Oxethazaine structure
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Oxethazaine

TL;DR: Oxethazaine (CAS 126-27-2) is a chemical compound with molecular formula C28H41N3O3 and molecular weight 467.3148 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-hydroxyethyl-[2-[methyl-(2-methyl-1-phenylpropan-2-yl)amino]-2-oxoethyl]amino]-N-methyl-N-(2-methyl-1-phenylpropan-2-yl)acetamide

Also Known As: Oxethazaine, Oxetacaine, Oxethacaine, Mucaine, Oxaine

CAS Number
126-27-2
Molecular Formula
C28H41N3O3
Molecular Weight
467.3148 g/mol
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Application Areas

Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.

Analytical Reagents (13 patents) Biotechnology (7 patents) Catalysts (5 patents) Food Additives (3 patents) Heterocyclic Building Blocks (92 patents)

Technical Specifications

Molecular FormulaC28H41N3O3
Molecular Weight467.3148 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)64.1 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors4
Rotatable Bonds12
Exact Mass467.3148 Da
Heavy Atoms34
Complexity585.0
Melting Point219 to 220 °F (NTP, 1992)
Boiling Point630
Solubilityless than 1 mg/mL at 73 °F (NTP, 1992)
SMILESCC(C)(CC1=CC=CC=C1)N(C)C(=O)CN(CCO)CC(=O)N(C)C(C)(C)CC2=CC=CC=C2
InChIKeyFTLDJPRFCGDUFH-UHFFFAOYSA-N

Product Description

Applications: Oxethazaine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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).

Oxethazaine is a pharmaceutical intermediate identified by CAS number 126-27-2 and the molecular formula C28H41N3O3 and a molecular weight of 467.31 g/mol. Physically, the compound has a solubility: less than 1 mg/mL at 73 °F (NTP, 1992). Synonyms include Oxethazaine and Oxetacaine.

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 Oxethazaine

XLogP
3.8
TPSA (Topological Polar Surface Area)
64.1
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
4
Rotatable Bonds
12
Heavy Atoms
34
Complexity
585.0
Exact Mass
467.3148
Monoisotopic Mass
467.3148
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 Oxethazaine

The XLogP value of 3.8 indicates that Oxethazaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Oxethazaine. Following Lipinski's Rule of Five, Oxethazaine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Oxethazaine?

The CAS number of Oxethazaine is 126-27-2.

What is the molecular formula of Oxethazaine?

The molecular formula of Oxethazaine is C28H41N3O3.

What is the molecular weight of Oxethazaine?

The molecular weight of Oxethazaine is 467.3148 g/mol.

What are the applications of Oxethazaine?

Oxethazaine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Oxethazaine?

You can request a quote for Oxethazaine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Oxethazaine?

Yes, CoreyChem provides custom synthesis services for Oxethazaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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