Nonadecanenitrile

Base Information

• Chemical Name: Nonadecanenitrile
• CAS No.: 28623-46-3
• Deprecated CAS: 891491-62-6
• Molecular Formula: C19H37 N
• Molecular Weight: 279.509
• Hs Code.: 2926909090
• European Community (EC) Number: 268-861-7,249-107-6
• NSC Number: 148361
• DSSTox Substance ID: DTXSID50873468
• Nikkaji Number: J109.747D
• Wikidata: Q81978943
• Mol file: 28623-46-3.mol

Synonyms:Nonadecanenitrile;n-Nonadecanonitrile;28623-46-3;Nonadecanonitrile;Octadecyl cyanide;1-Cyanooctadecane;Nitriles, C16-22;EINECS 249-107-6;EINECS 268-861-7;NSC 148361;68153-02-6;EC 268-861-7;Stearyl Cyanide;C19H37N;NSC148361;Nitriles, C16-2-2;SCHEMBL2155621;DTXSID50873468;MFCD00019850;AKOS024332958;NSC-148361;AS-57178;FT-0638791;N0458;D91712

Chemical Property of Nonadecanenitrile

Chemical Property:

• Melting Point: 43°C
• Refractive Index: 1.4415 (estimate)
• Boiling Point: 369.5°Cat760mmHg
• Flash Point: 145.7°C
• PSA: 23.79000
• Density: 0.832g/cm³
• LogP: 7.16158
• Water Solubility.: Practically insoluble in water
• XLogP3: 8.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 16
• Exact Mass: 279.292600184
• Heavy Atom Count: 20
• Complexity: 213

Purity/Quality:

98%,99%, ^*data from raw suppliers

Nonadecanenitrile >97.0%(GC) ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: UVCB
• Canonical SMILES: CCCCCCCCCCCCCCCCCCC#N

Technology Process of Nonadecanenitrile

There total 8 articles about Nonadecanenitrile 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: 95.1%

1-chlorooctadecane (3386-33-2) + 2-hydroxy-2-methylpropanenitrile (75-86-5) → N-nonadecyl nitrile (28623-46-3)

Guidance literature:

2-hydroxy-2-methylpropanenitrile; With lithium hydroxide monohydrate; In tetrahydrofuran; at 50 ℃; for 1h;

1-chlorooctadecane; In tetrahydrofuran;

Reference yield: 94.5%

→ N-nonadecyl nitrile (28623-46-3)

Guidance literature:

With sodium acetate; tin(II) bromide; In methanol; at 150 ℃; for 0.3h; under 11251.1 Torr; Flow reactor;

Reference yield:

1-chlorooctadecane (3386-33-2) → N-nonadecyl nitrile (28623-46-3)

Guidance literature:

upstream raw materials:

n-iodooctadecane

potassium cyanide

n-octadecyl p-toluenesulfonate

1-octadecanol

Downstream raw materials:

octadecane

1-nonadecanamine (n-nonadecylamine)

Refernces

• 1、 -. "Method for continuous preparation of nitriles in a pipelined reactor (by machine translation)". Paragraph 0036-0054; 0059-0097. . Retrieved 2020/12/14.
• 2、 -. "Process for the preparation of acyl cyanide compounds". . . Retrieved 2008/06/13.