2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol

Base Information

• Chemical Name: 2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol
• CAS No.: 143337-72-8
• Molecular Formula: C₁₃H₂₃NO₃
• Molecular Weight: 241.331
• Nikkaji Number: J503.337C
• Wikidata: Q76389231
• Mol file: 143337-72-8.mol

Synonyms:BRN 5810122;2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol;143337-72-8;Ethanol, 2,2'-((5-butoxy-4-penten-2-ynyl)imino)bis-;2-[[(E)-5-butoxypent-4-en-2-ynyl]-(2-hydroxyethyl)amino]ethanol;LS-66528;2,2'-(5-Butoxy-4-penten-2-ynylimino)bis(ethanol)

Chemical Property of 2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol

Chemical Property:

• Vapor Pressure: 7.62E-08mmHg at 25°C
• Boiling Point: 394.1°Cat760mmHg
• Flash Point: 192.1°C
• PSA: 52.93000
• Density: 1.055g/cm³
• LogP: 0.60680
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 241.16779360
• Heavy Atom Count: 17
• Complexity: 246

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC=CC#CCN(CCO)CCO
• Isomeric SMILES: CCCCO/C=C/C#CCN(CCO)CCO

Technology Process of 2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol

There total 1 articles about 2,2'-((5-Butoxy-4-penten-2-ynyl)imino)bisethanol 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: 63.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 1-butoxy-but-1-en-3-yne (2798-72-3) + 2,2'-iminobis[ethanol] (111-42-2) → 2-[((E)-5-Butoxy-pent-4-en-2-ynyl)-(2-hydroxy-ethyl)-amino]-ethanol (143337-72-8)

Guidance literature:

With copper(l) chloride; In 1,4-dioxane; for 2h; Heating;

DOI:10.1007/BF00766458

Reference yield: 80.0%

ethyl iodide (75-03-6) + 2-[((E)-5-Butoxy-pent-4-en-2-ynyl)-(2-hydroxy-ethyl)-amino]-ethanol (143337-72-8) → ((E)-5-Butoxy-pent-4-en-2-ynyl)-triethyl-ammonium; iodide (143337-74-0)

Guidance literature:

In acetonitrile; for 2h; Heating;

DOI:10.1007/BF00766458

upstream raw materials:

formaldehyd

1-butoxy-but-1-en-3-yne

2,2'-iminobis[ethanol]

Downstream raw materials:

((E)-5-Butoxy-pent-4-en-2-ynyl)-triethyl-ammonium; iodide

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