Decanoyl chloride

Base Information

• Chemical Name: Decanoyl chloride
• CAS No.: 112-13-0
• Molecular Formula: C10H19ClO
• Molecular Weight: 190.713
• Hs Code.: DERIVATION
• European Community (EC) Number: 203-938-0
• UNII: FJ16IN0UIM
• DSSTox Substance ID: DTXSID4059413
• Nikkaji Number: J79.449J
• Wikidata: Q65502134
• Mol file: 112-13-0.mol

Synonyms:Decanoyl chloride;112-13-0;decanoylchloride;Capric acid chloride;n-Decanoyl chloride;decanoic acid chloride;C10H19ClO;EINECS 203-938-0;FJ16IN0UIM;EC 203-938-0;Capric chloride;Caprinoyl chloride;caprinic acid chloride;n-decanoic acid chloride;Decanoyl chloride, 98%;UNII-FJ16IN0UIM;SCHEMBL234531;DTXSID4059413;BBL011427;MFCD00000771;STL146534;AKOS005720773;AS-14705;BP-31006;LS-185318;D0027;Decanoyl chloride, purum, >=98.0% (GC);FT-0654464;F87726;A802494;J-002709;J-520212

Chemical Property of Decanoyl chloride

Chemical Property:

• Appearance/Colour: clear liquid
• Vapor Pressure: 0.0572mmHg at 25°C
• Melting Point: -87 °C
• Refractive Index: n20/D 1.441(lit.)
• Boiling Point: 233 °C at 760 mmHg
• Flash Point: 106.1 °C
• PSA: 17.07000
• Density: 0.943 g/cm³
• LogP: 3.89250
• Storage Temp.: Store below +30°C.
• Sensitive.: Moisture Sensitive
• Water Solubility.: 100 mg/L (20 ºC)
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 190.1124429
• Heavy Atom Count: 12
• Complexity: 112

Purity/Quality:

99% ^*data from raw suppliers

Decanoyl Chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37-29-20/22
• Safety Statements: 26-36/37/39-45-8

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Toxic Gases & Vapors -> Acid Halides
• Canonical SMILES: CCCCCCCCCC(=O)Cl
• Uses: Decanoyl chloride is used in the synthesis of oligomers composed of alternating 2,6-diaminopyridine and 2,6-pyridinedicarbonyl units. It enhances the activity of proleather from Bacillus sp. during the synthesis of poly(lactic acid) in organic solvents.

Technology Process of Decanoyl chloride

There total 9 articles about Decanoyl chloride 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: 100.0%

1-decanoic acid (334-48-5) → n-decanoyl chloride (112-13-0)

Guidance literature:

With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; at 0 - 20 ℃; for 4h;

Reference yield: 68.0%

Hexanoyl chloride (142-61-0) → metacyclophane + n-decanoyl chloride (112-13-0)

Guidance literature:

Reference yield: 68.0%

→ Hexanoyl chloride (142-61-0) + n-decanoyl chloride (112-13-0)

Guidance literature:

upstream raw materials:

1-decanoic acid

oct-1-ene

maleic anhydride

6-aminohexanoic acid

Downstream raw materials:

4-decanoyl-5-methyl-pyrrole-2-carboxylic acid ethyl ester

3-dodecanone

capric anhydride

N-(p-tolyl)decanamide

Refernces

• 1、 Attygalle, Athula B.,Nishshanka, Upul,Weisbecker, Carl S.. ""Meta elimination," a diagnostic fragmentation in mass spectrometry". . p. 1515 - 1525. Retrieved 2011.
• 2、 Vizitiu, Despina,Lazar, Carmen,Halden, Brian J.,Lemieux, Robert P.. "Ferroelectric liquid crystals induced by atropisomeric dopants: Dependence of the polarization power on the core structure of the smectic C host". . p. 8229 - 8236. Retrieved 1999.
• 3、 Holas, Tomas,Vavrova, Katerina,Sima, Martin,Klimentova, Jana,Hrabalek, Alexandr. "Synthesis and transdermal permeation-enhancing activity of carbonate and carbamate analogs of Transkarbam 12". . p. 7671 - 7680. Retrieved 2006.
• 4、 Sivaramakrishna,Swamy, Musti J.. "Differential scanning calorimetric and powder X-ray diffraction studies on a homologous series of N-acyl-L-alanine esters with matched chains (n = 9-18)". . p. 1627 - 1635. Retrieved 2015.
• 5、 Abbas, Qamar,Ashraf, Saba,Channar, Pervaiz Ali,Hassan, Abbas,Hassan, Mubashar,Rafique, Hummera,Raza, Hussain,Rind, Mahboob Ali,Saeed, Aamer,Seo, Sung-Yum,Ujan, Rabail,Ul-Hamid, Anwar. "Benzimidazole tethered thioureas as a new entry to elastase inhibition and free radical scavenging: Synthesis, molecular docking, and enzyme inhibitory kinetics". . . Retrieved 2021.
• 6、 Ujan, Rabail,Saeed, Aamer,Ashraf, Saba,Channar, Pervaiz Ali,Abbas, Qamar,Rind, Mahboob Ali,Hassan, Mubashir,Raza, Hussain,Seo, Sung-Yum,El-Seedi, Hesham R.. "Synthesis, computational studies and enzyme inhibitory kinetics of benzothiazole-linked thioureas as mushroom tyrosinase inhibitors". . p. 7035 - 7043. Retrieved 2020/08/12.