Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate

Base Information

• Chemical Name: Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate
• CAS No.: 72814-29-0
• Molecular Formula: C21H36 N2 O5
• Molecular Weight: 396.527
• European Community (EC) Number: 276-865-5
• DSSTox Substance ID: DTXSID601144829
• Nikkaji Number: J318.837J
• Wikidata: Q107967383
• Mol file: 72814-29-0.mol

Synonyms:72814-29-0;Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate;EINECS 276-865-5;SCHEMBL11086802;XLZWPJLGBYQJNH-UHFFFAOYSA-N;DTXSID601144829;NS00062113;5-(6-ethoxycarbonylhexyl)-1-(3-cyclohexyl-3-hydroxypropyl)hydantoin;Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxo-4-imidazolidineheptanoate

Chemical Property of Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate

Chemical Property:

• PSA: 99.43000
• Density: 1.109g/cm³
• LogP: 3.35560
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 13
• Exact Mass: 396.26242225
• Heavy Atom Count: 28
• Complexity: 519

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CCCCCCC1C(=O)NC(=O)N1CCC(C2CCCCC2)O

Technology Process of Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate

There total 3 articles about Ethyl 3-(3-cyclohexyl-3-hydroxypropyl)-2,5-dioxoimidazolidine-4-heptanoate 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:

sulfuric acid (7664-93-9) + 5-(6-carboxyhexyl)-1-(3-cyclohexyl-3-hydroxypropyl) hydantoin (75693-75-3) → 7-[3-(3-cyclohexyl-3-hydroxy-propyl)-2,5-dioxo-imidazolidin-4-yl]-heptanoic acid ethyl ester (72814-29-0,94292-26-9,94292-29-2)

Guidance literature:

In ethanol; water;

Reference yield:

sulfuric acid (7664-93-9) + 5-(6-carboxyhexyl)-1-(3-cyclohexyl-3-hydroxypropyl) hydantoin (75693-75-3) → 5-(6-ethoxycarbonylhexyl)-1-(3-hydroxy-3-cyclohexyl)hydantoin + 7-[3-(3-cyclohexyl-3-hydroxy-propyl)-2,5-dioxo-imidazolidin-4-yl]-heptanoic acid ethyl ester (72814-29-0,94292-26-9,94292-29-2)

Guidance literature:

In ethanol; water;

Reference yield:

→ 7-[3-(3-cyclohexyl-3-hydroxy-propyl)-2,5-dioxo-imidazolidin-4-yl]-heptanoic acid ethyl ester (72814-29-0,94292-26-9,94292-29-2)

Guidance literature:

Aus der diastereomeren Saeure (mp: 124-126grad) und Ethanol;

upstream raw materials:

sulfuric acid

5-(6-carboxyhexyl)-1-(3-cyclohexyl-3-hydroxypropyl) hydantoin

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