N-Octadecylaniline

Base Information

• Chemical Name: N-Octadecylaniline
• CAS No.: 25417-58-7
• Molecular Formula: C24H43 N
• Molecular Weight: 345.612
• Hs Code.: 2921420090
• European Community (EC) Number: 246-961-1
• NSC Number: 58222,57087
• DSSTox Substance ID: DTXSID30180081
• Nikkaji Number: J250.456A
• Wikidata: Q83050582
• Mol file: 25417-58-7.mol

Synonyms:N-Octadecylaniline;25417-58-7;EINECS 246-961-1;NSC58222;NCIOpen2_007550;SCHEMBL634078;C24H43N;DTXSID30180081;NSC57087;C24-H43-N;NSC 57087;NSC 58222;NSC-57087;NSC-58222

Chemical Property of N-Octadecylaniline

Chemical Property:

• Vapor Pressure: 1.5E-08mmHg at 25°C
• Boiling Point: 457.3°Cat760mmHg
• Flash Point: 234.3°C
• PSA: 12.03000
• Density: 0.887g/cm³
• LogP: 8.43300
• XLogP3: 10.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 18
• Exact Mass: 345.339550376
• Heavy Atom Count: 25
• Complexity: 245

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCNC1=CC=CC=C1

Technology Process of N-Octadecylaniline

There total 8 articles about N-Octadecylaniline 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%

1-octadecanol (112-92-5) + aniline (62-53-3) → N-octadecylbenzeneamine (25417-58-7)

Guidance literature:

With bis(1,5-cyclooctadiene)nickel ⁽⁰⁾; potassium hydroxide; at 140 ℃; for 18h;

DOI:10.1039/c8cy01200h

Reference yield: 80.0%

aniline (62-53-3) + 1-Bromooctadecane (112-89-0) → N-octadecylbenzeneamine (25417-58-7)

Guidance literature:

With sodium hydroxide; tetrabutylammomium bromide; In toluene; at 70 - 80 ℃; for 168h;

DOI:10.1002/chem.200500830

Reference yield: 68.0%

aniline (62-53-3) + stearic acid (57-11-4) → N-octadecylbenzeneamine (25417-58-7)

Guidance literature:

With cobalt(II) tetrafluoroborate hexahydrate; (p-anisyl)triphos; hydrogen; In 1,4-dioxane; at 140 ℃; for 24h; under 30003 Torr; Autoclave; Green chemistry;

DOI:10.1002/anie.201806132

upstream raw materials:

n-octadecyl p-toluenesulfonate

aniline

1-Bromooctadecane

phenyl trimethylsiloxane

Downstream raw materials:

10-Octadecyl-3-phenyl-10H-pyrimido[4,5-b]quinoline-2,4-dione

C₂₅H₄₂ClNO