10-Chlorodecanoic acid

Base Information

• Chemical Name: 10-Chlorodecanoic acid
• CAS No.: 37027-56-8
• Molecular Formula: C10H19ClO2
• Molecular Weight: 206.713
• DSSTox Substance ID: DTXSID10190527
• Nikkaji Number: J40.814J
• Wikidata: Q83062916
• Mol file: 37027-56-8.mol

Synonyms:10-Chlorodecanoic acid;37027-56-8;Chlorundecanic acid;DECANOIC ACID, 10-CHLORO-;BRN 1765023;4-02-00-01053 (Beilstein Handbook Reference);SCHEMBL4518428;DTXSID10190527;LS-59342

Chemical Property of 10-Chlorodecanoic acid

Chemical Property:

• Vapor Pressure: 5.33E-05mmHg at 25°C
• Boiling Point: 323.5°Cat760mmHg
• Flash Point: 149.4°C
• Density: 1.035g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 9
• Exact Mass: 206.1073575
• Heavy Atom Count: 13
• Complexity: 126

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(CCCCC(=O)O)CCCCCl

Technology Process of 10-Chlorodecanoic acid

There total 9 articles about 10-Chlorodecanoic 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: 87.0%

10-chlorodecanol (51309-10-5) → 10-chlorodecanoic acid (37027-56-8)

Guidance literature:

With periodic acid; pyridinium chlorochromate; In acetonitrile; at 0 - 20 ℃; for 3h;

DOI:10.1016/j.ejmech.2017.04.034

Reference yield: 75.0%

methyl 10-chloroundecanoate (71194-27-9) → 10-chlorodecanoic acid (37027-56-8)

Guidance literature:

With sodium hydroxide; In methanol; water; at 40 ℃; for 6h; Inert atmosphere;

DOI:10.1002/anie.201706893

Reference yield: 54.0%

carbon dioxide (124-38-9,18923-20-1) + 8-bromo-1-chlorononane → 10-chlorodecanoic acid (37027-56-8)

Guidance literature:

With nickel(II) iodide; manganese; C₃₆H₄₀N₂; In N,N-dimethyl-formamide; at 25 ℃; for 20h; under 760.051 Torr; regioselective reaction;

DOI:10.1038/nature22316

upstream raw materials:

10-chlorodecanol

10-hydroxydecanoic acid

11-chloro-1-undecyne

carbon dioxide

Downstream raw materials:

1,18-difluoro-octadecane

10-aminodecanoic acid

Refernces

• 1、 Sahoo, Basudev,Bellotti, Peter,Juliá-Hernández, Francisco,Meng, Qing-Yuan,Crespi, Stefano,K?nig, Burkhard,Martin, Ruben. "Site-Selective, Remote sp3 C?H Carboxylation Enabled by the Merger of Photoredox and Nickel Catalysis". supporting information. p. 9001 - 9005. Retrieved 2019/06/24.
• 2、 Juliá-Hernández, Francisco,Moragas, Toni,Cornella, Josep,Martin, Ruben. "Remote carboxylation of halogenated aliphatic hydrocarbons with carbon dioxide". . p. 84 - 88. Retrieved 2017/05/12.