N4,N9-Dimethylspermine

Base Information

• Chemical Name: N4,N9-Dimethylspermine
• CAS No.: 61345-87-7
• Molecular Formula: C12H30N4
• Molecular Weight: 230.397
• DSSTox Substance ID: DTXSID10599713
• Nikkaji Number: J2.913.683A
• Wikidata: Q82495642

Synonyms:N4,N9-Dimethylspermine;61345-87-7;N1,N1'-(butane-1,4-diyl)bis(N1-methylpropane-1,3-diamine);bismethylspermine;SCHEMBL8736488;DTXSID10599713;N,N'-bis(3-aminopropyl)-N,N'-dimethylbutane-1,4-diamine;CS-M3515;MFCD30491850;AKOS037650619;CS-15074;SY318895;C13032;N~1~,N~4~-Bis(3-aminopropyl)-N~1~,N~4~-dimethylbutane-1,4-diamine;(3-AMINOPROPYL)({4-[(3-AMINOPROPYL)(METHYL)AMINO]BUTYL})METHYLAMINE;N1,N1 inverted exclamation mark -(Butane-1,4-diyl)bis(N1-methylpropane-1,3-diamine)

Chemical Property of N4,N9-Dimethylspermine

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 11
• Exact Mass: 230.24704697
• Heavy Atom Count: 16
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(CCCCN(C)CCCN)CCCN

Technology Process of N4,N9-Dimethylspermine

There total 4 articles about N4,N9-Dimethylspermine 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: 90.0%

di-tert-butyl ((butane-1,4-diylbis(methylazanediyl))bis(propane-3,1-diyl))dicarbamate → N,N <(amino-3 propyl) methyl> N',N'<(amino-3 propyl) methyl> butane diamine-1,4 (61345-87-7)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; water; at 0 - 20 ℃; for 4h;

DOI:10.1002/anie.201503041

Reference yield: 37.0%

N,N <(dimethyl-2,5 pyrolido)-3 propyl> N,N'dimethyl butane diamine 1,4 (121259-53-8) → N,N <(amino-3 propyl) methyl> N',N'<(amino-3 propyl) methyl> butane diamine-1,4 (61345-87-7)

Guidance literature:

With potassium carbonate; In ethanol; at 80 ℃; for 96h; Heating;

Reference yield:

C12H22N4 (61345-88-8) → N,N <(amino-3 propyl) methyl> N',N'<(amino-3 propyl) methyl> butane diamine-1,4 (61345-87-7)

Guidance literature:

With hydrogen; In ethanol; under 2585.81 Torr;

DOI:10.1016/j.tetlet.2010.10.164

upstream raw materials:

N,N <(dimethyl-2,5 pyrolido)-3 propyl> N,N'dimethyl butane diamine 1,4

2-(3-bromopropyl)isoindole-1,3-dione

C₁₂H₂₂N₄

Downstream raw materials:

(2E,2'E)-N,N'-(3,3'-(butane-1,4-diylbis(methylazanediyl))bis(propane-3,1-diyl))bis(2-(benzyloxyimino)-3-(3,5-dibromo-4-methoxyphenyl)propanamide)

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