Dioctanoyl peroxide

Base Information

• Chemical Name: Dioctanoyl peroxide
• CAS No.: 762-16-3
• Molecular Formula: C16H30 O4
• Molecular Weight: 286.412
• European Community (EC) Number: 212-094-2
• UN Number: 3106
• UNII: H709TZ1FAF
• DSSTox Substance ID: DTXSID0061086
• Nikkaji Number: J5.230B
• Wikidata: Q27279717
• Mol file: 762-16-3.mol

Synonyms:Dioctanoyl peroxide;762-16-3;Octanoyl peroxide;Peroxide, bis(1-oxooctyl);octanoyl octaneperoxoate;Caprolyl peroxide;CAPRYLYL PEROXIDE;Dicaprylyl peroxide;Capryl peroxide;UNII-H709TZ1FAF;H709TZ1FAF;HSDB 2752;EINECS 212-094-2;PERKADOX SE;SCHEMBL24125;CAPRYLYL PEROXIDE [HSDB];DTXSID0061086;MFCD00126877;NA2129;UN2129;AKOS028108376;A865536;Q27279717

Chemical Property of Dioctanoyl peroxide

Chemical Property:

• Vapor Pressure: 3.57E-05mmHg at 25°C
• Melting Point: 29 °C
• Refractive Index: 1.4340 (estimate)
• Boiling Point: 353.5°C at 760 mmHg
• Flash Point: 149.3°C
• PSA: 52.60000
• Density: 0.955g/cm³
• LogP: 4.70880
• Water Solubility.: 7μg/L at 20℃
• XLogP3: 6.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 15
• Exact Mass: 286.21440943
• Heavy Atom Count: 20
• Complexity: 225
• Transport DOT Label: Organic Peroxide

Purity/Quality:

99.9% ^*data from raw suppliers

CaprylylPeroxide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Other Classes -> Peroxides, Organic
• Canonical SMILES: CCCCCCCC(=O)OOC(=O)CCCCCCC
• Uses: Caprylyl Peroxide is used as a catalyst in preparation of poly(vinyl chloride) latexes.

Technology Process of Dioctanoyl peroxide

There total 3 articles about Dioctanoyl peroxide 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: 98.6%

n-octanoic acid chloride (111-64-8) → octanoyl peroxide (762-16-3)

Guidance literature:

With sodium hydroxide; dihydrogen peroxide; In dichloromethane; at 20 ℃;

DOI:10.1081/SCC-120002516

Reference yield: 80.0%

Octanoic acid (124-07-2) → octanoyl peroxide (762-16-3)

Guidance literature:

Octanoic acid; With dmap; dihydrogen peroxide; In dichloromethane; at -15 ℃; for 0.25h;

With dicyclohexyl-carbodiimide; In dichloromethane; for 3h;

DOI:10.1021/acs.joc.9b02875

Reference yield:

→ octanoyl peroxide (762-16-3)

Guidance literature:

upstream raw materials:

n-octanoic acid chloride

Octanoic acid

Downstream raw materials:

2-heptyl-5-isopentyl-3-methyl-hydroquinone

1-(non-1-enyl)benzene

1-((E)-non-1-enyl)benzene

(Z)-1-(non-1-enyl)benzene

Refernces

• 1、 Ghosh, Subhendu,Mir, Bilal Ahmad,Patel, Bhisma K.,Rajamanickam, Suresh,Sah, Chitranjan,Sethi, Garima,Venkataramani, Sugumar,Yadav, Vinita. "Bu4NI-Catalyzed, Radical-Induced Regioselective N-Alkylations and Arylations of Tetrazoles Using Organic Peroxides/Peresters". . p. 2118 - 2141. Retrieved 2020/03/13.
• 2、 Zhu, Xiaotao,Su, Muqiao,Zhang, Qi,Li, Yajun,Bao, Hongli. "Cu-Catalyzed Alkylarylation of Vinylarenes with Masked Alkyl Electrophiles". supporting information. p. 620 - 625. Retrieved 2020/01/02.