2-((4-Aminopentyl)(ethyl)amino)ethanol

Base Information

• Chemical Name: 2-((4-Aminopentyl)(ethyl)amino)ethanol
• CAS No.: 69559-11-1
• Molecular Formula: C9H22N2O
• Molecular Weight: 174.286
• Hs Code.: 2922199090
• European Community (EC) Number: 274-039-9
• UNII: F79D4A39YW
• DSSTox Substance ID: DTXSID90989592
• Nikkaji Number: J318.001H
• Mol file: 69559-11-1.mol

Synonyms:69559-11-1;2-((4-Aminopentyl)(ethyl)amino)ethanol;2-(4-Aminopentyl(ethyl)amino)ethanol;2-[(4-aminopentyl)(ethyl)amino]ethanol;5-(N-ethyl-N-2-hydroxyethylamino)-2-penthlamine;2-[4-aminopentyl(ethyl)amino]ethanol;EINECS 274-039-9;5-(N-ethyl-n-2-hydroxyethylamino)-2-pentylamine;MFCD03788185;2-[(4-Aminopentyl)ethylamino]ethanol;2-[(4-aminopentyl)(ethyl)amino]ethan-1-ol;2-((4-Aminopentyl)(ethyl)amino)ethan-1-ol;Hydroxynovaldiamine;4-Amino-N-ethyl-(2-hydroxyethyl)-pentylamine;F79D4A39YW;SCHEMBL5787559;DTXSID90989592;BCP32637;AC9483;AKOS006276141;2-[(4-amino-pentyl)ethylamino]ethanol;AS-14591;SY254057;Ethanol, 2-[(4-aminopentyl)ethylamino]-;Ethyl-N-2-hydroxyethylamino)-2-penthlamine;CS-0124046;FT-0617586;FT-0652739;(+/-)-2-[(4-Aminopentyl)ethylamino]ethanol;racemic 2-[(4-aminopentyl)ethylamino]-ethanol;2-[(4-Aminopentyl)ethylamino]ethanol, (+/-)-;EN300-7405822;A836546;W-104618;6-amino-2-(ethylamino)heptan-1-ol;5-(N-Ethyl-N-2-hydroxyethylamino)-2-penthlamine

Chemical Property of 2-((4-Aminopentyl)(ethyl)amino)ethanol

Chemical Property:

• Vapor Pressure: 0.00143mmHg at 25°C
• Refractive Index: 1.470-1474
• Boiling Point: 263.6 °C at 760 mmHg
• PKA: 14.76±0.10(Predicted)
• Flash Point: 113.2 °C
• PSA: 49.49000
• Density: 0.937 g/cm³
• LogP: 1.12830
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 174.173213330
• Heavy Atom Count: 12
• Complexity: 98.5

Purity/Quality:

99% ^*data from raw suppliers

5-(N-Ethyl-N-2-hydroxyethylamino)-2-penthlamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CCCC(C)N)CCO
• Uses: 2-(4-Aminopentyl(ethyl)amino)ethanol is a colorless and pure liquid that can be used as a pharmaceutical intermediate.

Technology Process of 2-((4-Aminopentyl)(ethyl)amino)ethanol

There total 7 articles about 2-((4-Aminopentyl)(ethyl)amino)ethanol 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: 97.0%

R(-)-5--2-pentanamine (159346-86-8) → rac-5--2-pentanamine (69559-11-1)

Guidance literature:

With nickel; In toluene; at 70 ℃; for 12h;

Reference yield: 95.9%

5-(N-ethyl-N-2-hydroxyethylamine)-2-pentanone (74509-79-8) → rac-5--2-pentanamine (69559-11-1)

Guidance literature:

With aluminum(III) nitrate nonahydrate; magnesium(II) nitrate hexahydrate; nickel(II) nitrate hexahydrate; yttrium(lll) nitrate hexahydrate; hydrogen; sodium carbonate; sodium hydroxide; In ethanol; ammonia; water; at 80 - 400 ℃; under 4500.45 Torr; Reagent/catalyst; Temperature; Pressure; Solvent; liquid NH₃;

Reference yield:

(E)-5-(ethyl(2-hydroxyethyl)amino)pentan-2-one oxime → rac-5--2-pentanamine (69559-11-1)

Guidance literature:

With hydrogen; In tetrahydrofuran; at 80 ℃; for 4h; under 7500.75 Torr; Inert atmosphere; Flow reactor;

DOI:10.3762/bjoc.14.45

upstream raw materials:

5-(N-ethyl-N-2-hydroxyethylamine)-2-pentanone

5-iodo-2-pentanone

3-acetyl-2-oxo-4,5-dihydrofuran

R(-)-5--2-pentanamine

Downstream raw materials:

hydroxychloroquine

(S)-hydroxychloroquine sulfate

R-(-)-hydroxychloroquine sulfate

Plaquenil

Refernces

• 1、 -. "Application of chiral chloroquine, hydroxychloroquine or salt of the chiral chloroquine and hydroxychloroquine as anti-coronavirus drug target 3CL hydrolase inhibitor for reducing cardiotoxicity". Paragraph 0120; 0126-0127. . Retrieved 2020/11/02.
• 2、 Yu, Eric,Mangunuru, Hari P.R.,Telang, Nakul S.,Kong, Caleb J.,Verghese, Jenson,Gilliland, Stanley E.,Ahmad, Saeed,Dominey, Raymond N.,Gupton, B. Frank. "High-yielding continuous-flow synthesis of antimalarial drug hydroxychloroquine". . p. 583 - 592. Retrieved 2018/03/21.