2-Hexyldecan-1-amine

Base Information

• Chemical Name: 2-Hexyldecan-1-amine
• CAS No.: 62281-05-4
• Molecular Formula: C16H35N
• Molecular Weight: 241.45600
• European Community (EC) Number: 834-434-4
• DSSTox Substance ID: DTXSID50571674
• Mol file: 62281-05-4.mol

Synonyms:2-Hexyldecan-1-amine;62281-05-4;2-n-hexyldecan-1-amine;1-Decanamine, 2-hexyl-;2-hexyldecyl amine;SCHEMBL1243948;DTXSID50571674;HEGUXAZWCQVLPV-UHFFFAOYSA-N;MFCD30475384;AKOS028109872;AS-75917;CS-0161408;H1634;T72719;A905868

Chemical Property of 2-Hexyldecan-1-amine

Chemical Property:

• Refractive Index: 1.4470 to 1.4510
• Boiling Point: 150°C/15mmHg(lit.)
• PKA: 10.80±0.10(Predicted)
• PSA: 26.02000
• Density: 0.813±0.06 g/cm3(Predicted)
• LogP: 5.98260
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 13
• Exact Mass: 241.276950121
• Heavy Atom Count: 17
• Complexity: 134

Purity/Quality:

≥99% ^*data from raw suppliers

2-Hexyldecan-1-amine >98.0%(GC)(T) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(CCCCCC)CN
• Uses: 2-Hexyldecan-1-amine is a reagent for the synthesis of triphenylene 2,3-dicarboxylic imides as luminescent liquid crystals, and the study of their optical and electronic properties.

Technology Process of 2-Hexyldecan-1-amine

There total 9 articles about 2-Hexyldecan-1-amine 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: 100.0%

2-(pentadecan-7-ylmethyl)isoindole-1,3-dione (1355961-63-5) → 2-n-hexyldecan-1-amine (62281-05-4)

Guidance literature:

With hydrazine hydrate; In methanol;

DOI:10.1039/c5ta05885f

Reference yield:

2-hexyldecanoyl amide (1608483-87-9) → 2-n-hexyldecan-1-amine (62281-05-4)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; for 2h;

Reference yield:

2-hexyldecan-1-ol (2425-77-6) → 2-n-hexyldecan-1-amine (62281-05-4)

Guidance literature:

Multi-step reaction with 3 steps

1: bromine; triphenylphosphine / dichloromethane / 12 h / 20 °C / Inert atmosphere

2: N,N-dimethyl-formamide / 18 h / 90 °C / Inert atmosphere

3: hydrazine hydrate / methanol / 95 °C / Inert atmosphere

With bromine; hydrazine hydrate; triphenylphosphine; In methanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/ja205398u

upstream raw materials:

1-bromo-hexane

2-(pentadecan-7-ylmethyl)isoindole-1,3-dione

2-hexyldecan-1-ol

7-(bromomethyl)pentadecane