5-Butylnonan-5-amine--hydrogen chloride (1/1)

Base Information

• Chemical Name: 5-Butylnonan-5-amine--hydrogen chloride (1/1)
• CAS No.: 56065-38-4
• Molecular Formula: C13H30ClN
• Molecular Weight: 235.837
• DSSTox Substance ID: DTXSID60971444

Synonyms:SCHEMBL22575376;DTXSID60971444;5-Butylnonan-5-amine--hydrogen chloride (1/1)

Chemical Property of 5-Butylnonan-5-amine--hydrogen chloride (1/1)

Chemical Property:

• Vapor Pressure: 0.0133mmHg at 25°C
• Boiling Point: 259°Cat760mmHg
• Flash Point: 106.2°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 9
• Exact Mass: 235.2066777
• Heavy Atom Count: 15
• Complexity: 98.6

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CCCC)(CCCC)N.Cl

Technology Process of 5-Butylnonan-5-amine--hydrogen chloride (1/1)

There total 3 articles about 5-Butylnonan-5-amine--hydrogen chloride (1/1) 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:

C17H37NOS → 5-butylnonan-5-amine hydrochloride (56065-38-4)

Guidance literature:

With hydrogenchloride; ethanol; at 0 - 20 ℃;

DOI:10.1016/j.tet.2019.06.016

Reference yield:

N-(1-butylpentylidene)-2-methyl-2-propanesulfinamide → 5-butylnonan-5-amine hydrochloride (56065-38-4)

Guidance literature:

Multi-step reaction with 2 steps

1: trimethylaluminum / hexane; toluene / -78 - 0 °C

2: hydrogenchloride; ethanol / 0 - 20 °C

With hydrogenchloride; ethanol; trimethylaluminum; In hexane; toluene;

DOI:10.1016/j.tet.2019.06.016

Reference yield:

nonanone-5 (502-56-7) → 5-butylnonan-5-amine hydrochloride (56065-38-4)

Guidance literature:

Multi-step reaction with 3 steps

1: titanium(IV) tetraethanolate / tetrahydrofuran / Reflux

2: trimethylaluminum / hexane; toluene / -78 - 0 °C

3: hydrogenchloride; ethanol / 0 - 20 °C

With hydrogenchloride; titanium(IV) tetraethanolate; ethanol; trimethylaluminum; In tetrahydrofuran; hexane; toluene;

DOI:10.1016/j.tet.2019.06.016

upstream raw materials:

nonanone-5

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