Decimemide

Base Information

• Chemical Name: Decimemide
• CAS No.: 14817-09-5
• Molecular Formula: C19H31 N O4
• Molecular Weight: 337.51
• Hs Code.: 2924299090
• UNII: GAF9GJ18J5
• DSSTox Substance ID: DTXSID70163893
• Nikkaji Number: J8.528F
• Wikidata: Q27278994
• NCI Thesaurus Code: C75162
• ChEMBL ID: CHEMBL91688
• Mol file: 14817-09-5.mol

Synonyms:Decimemide;14817-09-5;Denegyt;Decimemide [INN];4-(Decyloxy)-3,5-dimethoxybenzamide;Decimemida;Decimemidum;Decimemidum [INN-Latin];Decimemida [INN-Spanish];Egyt 1050;4-decoxy-3,5-dimethoxybenzamide;EGYT-1050;EGYT 1050;UNII-GAF9GJ18J5;BRN 2767383;GAF9GJ18J5;Benzamide, 4-(decyloxy)-3,5-dimethoxy-;V 285;4-n-Decyloxy-3,5-dimethoxybenzoic acid amide;C19H31NO4;DECIMEMIDE [MI];SCHEMBL80116;CHEMBL91688;C18H29NO4.C2H6;DTXSID70163893;CHEBI:135434;AKOS040751508;LS-26295;FT-0765020;V-285;Q27278994

Chemical Property of Decimemide

Chemical Property:

• Vapor Pressure: 4.29E-07mmHg at 25°C
• Melting Point: 121-122°
• Refractive Index: 1.5180 (estimate)
• Boiling Point: 414.9°C at 760 mmHg
• PKA: 15.96±0.50(Predicted)
• Flash Point: 106.6°C
• PSA: 71.77000
• Density: 1.026g/cm³
• LogP: 5.20640
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 13
• Exact Mass: 337.22530847
• Heavy Atom Count: 24
• Complexity: 323

Purity/Quality:

98%min ^*data from raw suppliers

DECIMEMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCOC1=C(C=C(C=C1OC)C(=O)N)OC

Technology Process of Decimemide

There total 2 articles about Decimemide 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: 69.0%

carbon monoxide (201230-82-2) + 5-bromo-2-(decyloxy)-1,3-dimethoxybenzene (1318800-20-2) → 4-(decyloxy)-3,5-dimethoxybenzamide (14817-09-5)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; (2R)-1-[(1R)-1-[bis(1,1-dimethylethyl)phosphino]ethyl]-2-(diphenylphosphino)ferrocene; ammonium carbamate; sodium hydrogencarbonate; In 1,4-dioxane; at 100 ℃; for 20h; Inert atmosphere;

DOI:10.1021/ol201808y

Reference yield:

→ 4-(decyloxy)-3,5-dimethoxybenzamide (14817-09-5)

Guidance literature:

entspr. Saeure, Harnstoff;

upstream raw materials:

carbon monoxide

5-bromo-2-(decyloxy)-1,3-dimethoxybenzene

Refernces