2-Buten-1-amine, N,N,3-trimethyl-

Base Information

• Chemical Name: 2-Buten-1-amine, N,N,3-trimethyl-
• CAS No.: 2588-79-6
• Molecular Formula: C7H15N
• Molecular Weight: 113.203
• DSSTox Substance ID: DTXSID90413928
• Nikkaji Number: J2.099.730C
• Mol file: 2588-79-6.mol

Synonyms:2-Buten-1-amine, N,N,3-trimethyl-;Dimethylprenylamin;2588-79-6;SCHEMBL2141526;DTXSID90413928;WFCAUNYFSHIYTM-UHFFFAOYSA-N;1-dimethylamino-3-methyl-2-butene

Chemical Property of 2-Buten-1-amine, N,N,3-trimethyl-

Chemical Property:

• PSA: 3.24000
• LogP: 1.51420
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 113.120449483
• Heavy Atom Count: 8
• Complexity: 78.4

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCN(C)C)C

Technology Process of 2-Buten-1-amine, N,N,3-trimethyl-

There total 3 articles about 2-Buten-1-amine, N,N,3-trimethyl- 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: 70.0%

dimethyl-(3,3-dimethylallyl)-(1-methoxycarbonylethyl)ammonium bromide (80070-17-3) → prenyldimethylamine (2588-79-6) + methyl 2-dimethylamino-2,3,3-trimethylpent-4-enoate (80070-22-0) + acrylic acid methyl ester (292638-85-8,9003-21-8,96-33-3)

Guidance literature:

With sodium methylate; In diethyl ether; at 30 - 35 ℃; Yield given;

Reference yield:

DIMCARB (4137-10-4) + isoprene (78-79-5,9003-31-0) → prenyldimethylamine (2588-79-6) + 1-Dimethylamino-2-methyl-2-butene (40267-41-2)

Guidance literature:

With sodium 1,4-bis[(di-m-sulfonatophenyl)phosphino]butane; palladium(II) trifluoroacetate; In neat (no solvent); at 100 ℃; for 3h; Overall yield = 93 %Chromat.; Catalytic behavior;

DOI:10.1039/c7gc02272g

Reference yield:

N-<3,3-dimethylallyl(dimethyl)ammonio>formamidide → cyanuric acid (108-80-5,27026-93-3,27941-25-9) + prenyldimethylamine (2588-79-6)

Guidance literature:

In benzene; for 12h; Heating;

DOI:10.1039/P19830001029

upstream raw materials:

dimethyl-(3,3-dimethylallyl)-(1-methoxycarbonylethyl)ammonium bromide

DIMCARB

isoprene

Downstream raw materials:

Dimethyl-(3-methyl-1-o-tolyl-but-2-enyl)-amine

(2,2-Dimethyl-1-phenyl-but-3-enyl)-dimethyl-amine

dimethyl-(3,3-dimethylallyl)-(1-phenylprop-2-ynyl)ammonium bromide

benzyl-dimethyl-(3-methyl-but-2-enyl)-ammonium; chloride