9,10-Dichlorostearic acid

Base Information

• Chemical Name: 9,10-Dichlorostearic acid
• CAS No.: 5829-48-1
• Molecular Formula: C18H34 Cl2 O2
• Molecular Weight: 353.373
• DSSTox Substance ID: DTXSID10858751
• Nikkaji Number: J330.597J
• Metabolomics Workbench ID: 1745
• Mol file: 5829-48-1.mol

Synonyms:9,10-dichlorostearic acid;diCl stearic acid;threo-9,10-dichlorostearic acid

Chemical Property of 9,10-Dichlorostearic acid

Chemical Property:

• Vapor Pressure: 1.25E-09mmHg at 25°C
• Boiling Point: 457.2°C at 760 mmHg
• Flash Point: 230.3°C
• PSA: 37.30000
• Density: 1.027g/cm³
• LogP: 7.11630
• XLogP3: 7.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 16
• Exact Mass: 352.1935857
• Heavy Atom Count: 22
• Complexity: 260

Purity/Quality:

99% ^*data from raw suppliers

DICHLOROSTEARIC ACID 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC(C(CCCCCCCC(=O)O)Cl)Cl

Technology Process of 9,10-Dichlorostearic acid

There total 7 articles about 9,10-Dichlorostearic acid 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: 71.0%

(+/-)-ethyl 9,10-dichlorooctadecanoate → (+/-)-9,10-dichlorooctadecanoic acid (5829-48-1,26631-51-6,41621-84-5)

Guidance literature:

With methanol; lithium hydroxide; In tetrahydrofuran; at 20 ℃; for 6h;

DOI:10.1021/ol102010h

Reference yield:

cis-Octadecenoic acid (112-80-1,2027-47-6) → (+/-)-9,10-dichlorooctadecanoic acid (5829-48-1,26631-51-6,41621-84-5)

Guidance literature:

With chloroform; chlorine; at -20 ℃;

Reference yield:

Elaidic acid (112-79-8,2027-47-6) → 9,10-dichlorooctadecanoic acid (5829-48-1)

Guidance literature:

With chloroform; chlorine;

upstream raw materials:

cis-Octadecenoic acid

Elaidic acid

Methyl oleate

Downstream raw materials:

9,10-dichlorostearic acid methyl ester

Dihydroxystearic Acid

Stearolic acid