(E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine

Base Information

• Chemical Name: (E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine
• CAS No.: 155272-10-9
• Molecular Formula: C₂₂H₂₆N₄O₅
• Molecular Weight: 426.472
• Wikidata: Q76389522
• Mol file: 155272-10-9.mol

Synonyms:(E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine;155272-10-9;Acetic acid, (4-(2-(1,3-diethyl-2,3,6,7-tetrahydro-7-methyl-2,6-dioxo-1H-purin-8-yl)ethenyl)phenoxy)-, ethyl ester, (E)-;ethyl 2-[4-[(E)-2-(1,3-diethyl-7-methyl-2,6-dioxopurin-8-yl)ethenyl]phenoxy]acetate;Acetic acid, (4-(2-(1,3-diethyl-2,3,6,7-tetrahydro-7-methyl-2,6-dioxo- 1H-purin-8-yl)ethenyl)phenoxy;SCHEMBL7313816;SCHEMBL7313822;OZUNVAJJGHFTJB-JLHYYAGUSA-N

Chemical Property of (E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine

Chemical Property:

• Vapor Pressure: 4.79E-16mmHg at 25°C
• Boiling Point: 635.4°C at 760 mmHg
• Flash Point: 338.1°C
• PSA: 97.35000
• Density: 1.25g/cm³
• LogP: 2.04880
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 426.19031994
• Heavy Atom Count: 31
• Complexity: 691

Purity/Quality:

99%min ^*data from raw suppliers

ACETIC ACID, (4-(2-(1,3-DIETHYL-2,3,6,7-TETRAHYDRO-7-METHYL-2,6-DIOXO-1H-PURIN-8-YL)ETHENYL)PHENOXY)-, ETHYL ESTER, (E)- 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)C=CC3=CC=C(C=C3)OCC(=O)OCC)C
• Isomeric SMILES: CCN1C2=C(C(=O)N(C1=O)CC)N(C(=N2)/C=C/C3=CC=C(C=C3)OCC(=O)OCC)C

Technology Process of (E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine

There total 1 articles about (E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine 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: 91.0%

→ (E)-8-(4-Ethoxycarbonylmethoxystyryl)-1,3-diethyl-7-methylxanthine (155272-10-9)

Guidance literature:

Refernces

• 1、 -. "Therapeutic agent for Parkinson's disease". . . Retrieved 2008/06/13.