Propylene glycol dicaprylate

Base Information

• Chemical Name: Propylene glycol dicaprylate
• CAS No.: 7384-98-7
• Deprecated CAS: 117657-09-7,145920-27-0,56519-70-1
• Molecular Formula: C19H36 O4
• Molecular Weight: 328.492
• Hs Code.: 2915900090
• European Community (EC) Number: 230-962-9
• UNII: 581437HWX2
• DSSTox Substance ID: DTXSID70864050
• Nikkaji Number: J106.479G
• Wikidata: Q27261533
• RXCUI: 1426619
• ChEMBL ID: CHEMBL2268847
• Mol file: 7384-98-7.mol

Synonyms:1,2-dicaprylin;1,2-propanediol dioctanoate

Chemical Property of Propylene glycol dicaprylate

Chemical Property:

• Vapor Pressure: 1.56E-06mmHg at 25°C
• Boiling Point: 397.7°C at 760 mmHg
• Flash Point: 184.3°C
• PSA: 52.60000
• Density: 0.939g/cm³
• LogP: 5.18230
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 6.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 17
• Exact Mass: 328.26135963
• Heavy Atom Count: 23
• Complexity: 302

Purity/Quality:

98%, ^*data from raw suppliers

Propane-1,2-diyldioctanoate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC(=O)OCC(C)OC(=O)CCCCCCC
• Uses: Propylene glycol dicaprylate is commonly used by the cosmetic industry in crams, lotions and topicals.

Technology Process of Propylene glycol dicaprylate

There total 1 articles about Propylene glycol dicaprylate 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: 49.0%

propylene glycol (57-55-6,63625-56-9) + n-octanoic acid chloride (111-64-8) → propylene glycol dicaprylate (7384-98-7,56519-70-1)

Guidance literature:

With pyridine; for 12h;

DOI:10.1016/0008-6215(92)85036-Y

upstream raw materials:

propylene glycol

n-octanoic acid chloride

Refernces