Stearonitrile

Base Information

• Chemical Name: Stearonitrile
• CAS No.: 638-65-3
• Molecular Formula: C18H35 N
• Molecular Weight: 265.483
• Hs Code.: 2926909090
• European Community (EC) Number: 211-345-3
• NSC Number: 5541
• UNII: QXY19Q5N5I
• DSSTox Substance ID: DTXSID4027280
• Nikkaji Number: J48.175K
• Wikidata: Q27287554
• Metabolomics Workbench ID: 125213
• ChEMBL ID: CHEMBL1871991
• Mol file: 638-65-3.mol

Synonyms:stearonitrile

Chemical Property of Stearonitrile

Chemical Property:

• Vapor Pressure: 2.62E-05mmHg at 25°C
• Melting Point: 38-40 °C(lit.)
• Refractive Index: 1.4389
• Boiling Point: 274 °C100 mm Hg(lit.)
• Flash Point: >230 °F
• PSA: 23.79000
• Density: 0.818 g/mL at 25 °C(lit.)
• LogP: 6.77148
• XLogP3: 8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 15
• Exact Mass: 265.276950121
• Heavy Atom Count: 19
• Complexity: 201

Purity/Quality:

98% ^*data from raw suppliers

Stearonitrile >92.0%(GC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 20/21/22
• Safety Statements: 36

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Nitrogen Compounds -> Nitriles
• Canonical SMILES: CCCCCCCCCCCCCCCCCC#N
• Uses: Stearonitrile was used to study the behaviour of dipalmitoylphosphatidylcholine mixed with stearonitrile at the air–water interface by surface pressure–area measurements and by direct visualisation of monolayers by Brewster angle microscopy. It was used to study the phase behaviour of stearic acid mixed with stearonitrile, in bulk and in a monolayer at the air–water interface.

Technology Process of Stearonitrile

There total 26 articles about Stearonitrile 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: 98.0%

thiostearamide (13144-71-3) → stearonitrile (638-65-3)

Guidance literature:

With tellurium tetrachloride; triethylamine; In chloroform; for 3h; Ambient temperature;

Reference yield: 95.0%

stearamide (124-26-5) → stearonitrile (638-65-3)

Guidance literature:

With triethylamine; trifluoroacetyl chloride; In dichloromethane;

DOI:10.1055/s-1985-31148

Reference yield: 92.0%

stearic acid (57-11-4) → stearonitrile (638-65-3)

Guidance literature:

With urea; at 80 - 300 ℃; Inert atmosphere;

DOI:10.1155/2020/1092643

upstream raw materials:

thiostearamide

isocyanuric acid

stearic acid

urea

Downstream raw materials:

2,4-diamino-6-heptadecyl-symm-triazine

2-heptadecyl-2-imidazoline

thiostearamide

Dioctadecylamine

Refernces

• 1、 Apriliyanto, Yusuf Bramastya,Darmawan, Noviyan,Dawolo, Januari,Mas'Ud, Zainal Alim. "Fatty Amidine as Copper Corrosion Inhibitor". . . Retrieved 2020/11/26.
• 2、 Achard, Thierry,Bellemin-Laponnaz, Stéphane,Chen, Weiguang,Egly, Julien,Maisse-Francois, Aline,Poblador-Bahamonde, Amalia I.. "Synthesis, characterization, catalytic and biological application of half-sandwich ruthenium complexes bearing hemilabile (κ2-: C, S)-thioether-functionalised NHC ligands". supporting information. p. 3243 - 3252. Retrieved 2020/03/19.