N-cyclooctylacetamide

Base Information

• Chemical Name: N-cyclooctylacetamide
• CAS No.: 31510-02-8
• Molecular Formula: C10H19 N O
• Molecular Weight: 169.267
• NSC Number: 179411
• DSSTox Substance ID: DTXSID40306710
• Nikkaji Number: J3.034.413H
• Wikidata: Q82053916
• Mol file: 31510-02-8.mol

Synonyms:N-cyclooctylacetamide;31510-02-8;NSC179411;SCHEMBL2047092;DTXSID40306710;AKOS003864439;NSC-179411;Z32415866

Chemical Property of N-cyclooctylacetamide

Chemical Property:

• Vapor Pressure: 0.000263mmHg at 25°C
• Boiling Point: 323.4°Cat760mmHg
• Flash Point: 190.7°C
• Density: 0.93g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 169.146664230
• Heavy Atom Count: 12
• Complexity: 137

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1CCCCCCC1

Technology Process of N-cyclooctylacetamide

There total 5 articles about N-cyclooctylacetamide 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%

Cyclooctan (292-64-8) + acetonitrile (75-05-8,26809-02-9) → cyclooctylacetamide (31510-02-8)

Guidance literature:

Cyclooctan; acetonitrile; With zinc trifluoromethanesulfonate; 1-(chloromethyl)-4-fluoro-1,4-diazoniabicyclo[2.2.2]octane bis(hexafluorophosphate); copper(ll) bromide; at 50 ℃; for 4h; Inert atmosphere;

With sodium hydroxide; In water; for 0.0833333h;

DOI:10.1021/ja212020b

Reference yield:

Cyclooctan (292-64-8) + acetonitrile (75-05-8,26809-02-9) → cis-Cyclooctene (931-88-4,931-87-3,25267-51-0) + bicyclooctyl (6708-17-4) + cyclooctylacetamide (31510-02-8)

Guidance literature:

With phosphotungstic acid; platinum; at 25 ℃; for 9.08333h; Rate constant; Product distribution; Irradiation; also other hydrocarbons;

DOI:10.1021/ja00224a034

Reference yield:

acetamide (60-35-5) + cis-Cyclooctene (931-88-4,931-87-3,25267-51-0) → cyclooctylacetamide (31510-02-8)

Guidance literature:

With sodium hydroxide; sodium tetrahydroborate; mercury(II) nitrate; N-butylamine; Yield given. Multistep reaction; 1) CH₂Cl₂, reflux, 2) CH₂Cl₂, 0 deg C;

DOI:10.1039/c39810000670

upstream raw materials:

acetamide

cis-Cyclooctene

cyclooctylamine

acetic anhydride

Downstream raw materials:

9-ethyl-9-azabicyclo<3.3.1>nonane

9-Ethyl-9-aza-bicyclo[4.2.1]nonane