Etofylline clofibrate

Base Information

• Chemical Name: Etofylline clofibrate
• CAS No.: 54504-70-0
• Molecular Formula: C19H21 Cl N4 O5
• Molecular Weight: 420.853
• European Community (EC) Number: 259-191-6
• NSC Number: 234348
• UNII: 14UH1JQP6L
• DSSTox Substance ID: DTXSID0023032
• Nikkaji Number: J13.081H
• Wikidata: Q27251653
• NCI Thesaurus Code: C152583
• ChEMBL ID: CHEMBL1318939
• Mol file: 54504-70-0.mol

Synonyms:4-chlorophenoxyisobutyrate theophylline-7-ethyl ester;Duolip;etofyllinclofibrate;etofylline clofibrate;etophylline clofibrate;ML 1024

Chemical Property of Etofylline clofibrate

Chemical Property:

• Vapor Pressure: 4.26E-15mmHg at 25°C
• Melting Point: 133-135°
• Refractive Index: 1.6500 (estimate)
• Boiling Point: 615.8°C at 760 mmHg
• Flash Point: 326.2°C
• PSA: 97.35000
• Density: 1.37g/cm³
• LogP: 1.48790
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 420.1200475
• Heavy Atom Count: 29
• Complexity: 653

Purity/Quality:

99% ^*data from raw suppliers

Etofyllineclofibrate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C(=O)OCCN1C=NC2=C1C(=O)N(C(=O)N2C)C)OC3=CC=C(C=C3)Cl
• Uses: Duolip (L. Merckle, Germany).
• Therapeutic Function: Antihyperlipidemic

Technology Process of Etofylline clofibrate

There total 2 articles about Etofylline clofibrate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 85.0%

clofibryl chloride (5542-60-9) + 7-(2-hydroxyethyl)theophylline (519-37-9) → Duolip (54504-70-0)

Guidance literature:

In xylene; for 2h; Heating;

Reference yield:

→ Duolip (54504-70-0)

Guidance literature:

7-Hydroxyethyltheophyllin, p-Toluolsulfonsaeure, 2-(p-Chlorophenoxy)isobuttersaeure, Xylol;

Reference yield:

Duolip (54504-70-0) → Clofibric acid (882-09-7) + 7-(2-hydroxyethyl)theophylline (519-37-9)

Guidance literature:

Product distribution; metabolism in vitro and in vivo in rats and dogs;

upstream raw materials:

clofibryl chloride

7-(2-hydroxyethyl)theophylline

Downstream raw materials:

Clofibric acid

7-(2-hydroxyethyl)theophylline