1-Chloroeicosane

Base Information

• Chemical Name: 1-Chloroeicosane
• CAS No.: 42217-02-7
• Molecular Formula: C20H41Cl
• Molecular Weight: 316.999
• Hs Code.: 2903199000
• European Community (EC) Number: 255-708-4
• UNII: WS6HS8YEK7
• DSSTox Substance ID: DTXSID60195042
• Nikkaji Number: J693I
• Wikidata: Q83067917
• Mol file: 42217-02-7.mol

Synonyms:1-CHLOROEICOSANE;42217-02-7;1-Chloroicosane;Chloroicosane;Eicosane, 1-chloro-;WS6HS8YEK7;EINECS 255-708-4;cosyl chloride;Eicosyl Chloride;1-Chloroicosane #;UNII-WS6HS8YEK7;C20H41Cl;SCHEMBL868627;DTXSID60195042;MFCD00058938;AKOS024390928;CS-0152201;FT-0743443;D89292

Chemical Property of 1-Chloroeicosane

Chemical Property:

• Melting Point: 37.6°C
• Refractive Index: 1.4580 (estimate)
• Boiling Point: 407.35°C (estimate)
• Flash Point: 31 °C
• PSA: 0.00000
• Density: 0.8862 (estimate)
• LogP: 8.26690
• XLogP3: 11.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 18
• Exact Mass: 316.2896790
• Heavy Atom Count: 21
• Complexity: 167

Purity/Quality:

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

1-Chloroeicosane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCl

Technology Process of 1-Chloroeicosane

There total 1 articles about 1-Chloroeicosane 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:

ethene (74-85-1) → 1-chloroeicosane (42217-02-7)

Guidance literature:

With hydrogenchloride; dibenzoyl peroxide; at 100 ℃; under 294203 - 367754 Torr;

DOI:10.1021/ja01137a023

Reference yield: 82.0%

1-chloroeicosane (42217-02-7) + 4-nitro-aniline (100-01-6,104810-17-5) → 4'-nitro-n-eicosaneanilide + 4'-amino-n-eicosaneanilide (198479-40-2)

Guidance literature:

With pyridine; In tetrahydrofuran;

Reference yield:

1-chloroeicosane (42217-02-7) + methyl 4-hydroxylbenzoate (99-76-3,156291-94-0) → 4-Icosyloxy-benzoic acid methyl ester (40654-40-8)

Guidance literature:

With sodium methylate; In N,N-dimethyl-formamide;

DOI:10.1021/jm00216a009

upstream raw materials:

ethene

Downstream raw materials:

4-Icosyloxy-benzoic acid methyl ester

4'-amino-n-eicosaneanilide