Sorbic chloride

Base Information

• Chemical Name: Sorbic chloride
• CAS No.: 2614-88-2
• Molecular Formula: C6H7ClO
• Molecular Weight: 130.574
• Hs Code.: 2916190090
• European Community (EC) Number: 626-416-8
• Nikkaji Number: J1.096.743K,J1.704.454K
• Wikidata: Q76305475
• Mol file: 2614-88-2.mol

Synonyms:Sorbic chloride;2614-88-2;(2E,4E)-hexa-2,4-dienoyl chloride;Sorboyl chloride;Sorbic acid chloride;(2E,4E)-2,4-Hexadienoyl chloride;Sorbicchloride;sorbyl chloride;(E,E)-2,4-Hexadienoyl chloride;trans,trans-2,4-Hexadienoyl chloride;trans,trans-Hexa-2,4-dienoyl chloride;2,4-Hexadienoic acid chloride;SCHEMBL2297852;CAA61488;MFCD00045227;rans,trans-2,4-Hexadienoyl chloride;AKOS006282298;(2E,4E)-2,4-Hexadienoyl chloride #;EN300-259925;EN300-624317;J-016281

Chemical Property of Sorbic chloride

Chemical Property:

• Refractive Index: 1.5545
• Boiling Point: 169.4°C (rough estimate)
• PSA: 17.07000
• Density: 1.0666
• LogP: 1.88410
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 130.0185425
• Heavy Atom Count: 8
• Complexity: 125

Purity/Quality:

98%,99%, ^*data from raw suppliers

Sorbic chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): 969473
• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

Useful:

• Canonical SMILES: CC=CC=CC(=O)Cl
• Isomeric SMILES: C/C=C/C=C/C(=O)Cl
• Uses: Reactant for:Preparation of unsaturated hydroxymethylene diphosphonic acid derivatives by reaction of trimethylsilyl phosphitesAsymmetrical synthesis of the isoindolinone subunit of the macrocyclic poylketide natural product muironolide A via stereoselective intramolecular Diels-Alder cycloadditionPreparation of emollient, humectant, and fluorescent α,β-unsaturated thiol esters for long-acting skin applicationsStereoselective synthesis of enediol carbonates for use in the asymmetrical synthesis of α-acyloxyketonesAcylation of pyrazoles

Technology Process of Sorbic chloride

There total 9 articles about Sorbic 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%

sorbic Acid (110-44-1,91751-55-2) → sorbinyl chloride (2614-88-2)

Guidance literature:

With thionyl chloride; In N,N-dimethyl-formamide; for 0.666667h; Heating;

DOI:10.1021/ja037927u

Reference yield: 79.0%

hexa-2,4-dienoic acid (110-44-1,91751-55-2) → (2E)-hexa-2,4-dienoyl chloride (2614-88-2,90554-82-8)

Guidance literature:

With oxalyl dichloride; In dichloromethane; N,N-dimethyl-formamide; for 2h;

DOI:10.1039/b404962d

Reference yield:

octadecyl S-sorbyl-3-mercaptopropionate + 2-(acetylamino)ethanethiol (1190-73-4) → sorbinyl chloride (2614-88-2)

Guidance literature:

In methanol; chloroform;

upstream raw materials:

sorbic Acid

2-(acetylamino)ethanethiol

(2E,4E)-methylhexa-2,4-dienoate

parasorbic acid

Downstream raw materials:

o-tolyl sorbate

hexadien-(2t,4t)-oic acid-⁽¹⁾-p-tolyl ester

(2E,4E)-phenyl hexa-2,4-dienoate

N²-(Hexa-2',4'-dienoyl)-N¹,N¹-dimethyl-methacrylamidin

Refernces

• 1、 Burmud?ija, Adrijana,Mu?kinja, Jovana,Ratkovi?, Zoran,Kosani?, Marijana,Rankovi?, Branislav,Novakovi?, Sladjana B.,Bogdanovi?, Goran A.. "Pyrazoline derivatives of acryloyl substituted ferrocenyl ketones: Synthesis, antimicrobial activity and structural properties". . p. 570 - 576. Retrieved 2018.
• 2、 Oe, Kentaro,Ohfune, Yasufumi,Shinada, Tetsuro. "Short total synthesis of (-)-kainic acid". . p. 2550 - 2553. Retrieved 2014.
• 3、 Lu, Mengxue,Xiong, Zongli,Zhou, Yuqiao,Wang, Xin,Li, Xiaoyi,Duan, Jingxiang,Yao, Weijun,Xia, Yi,Wang, Zhen. "Assembly of fluorinated chromanones: Via enantioselective tandem reaction". . p. 4722 - 4725. Retrieved 2021.
• 4、 Liu, Shu-Zhi,Tang, Guang-Shi,Wang, Jing,Li, Xue-Hua. "Synthesis, characterization, and intramolecular Diels-Alder reaction tandem dehydroaromatization of a diene-diyne". . p. 938 - 939. Retrieved 2005.
• 5、 Baruch, Yifat,Gopas, Jacob,Kadosh, Yael,Kumar, Rajendran Saravana,Kushmaro, Ariel,Muthuraman, Subramani,Yaniv, Karin. "Quorum sensing and nf-κb inhibition of synthetic coumaperine derivatives from piper nigrum". supporting information. . Retrieved 2021/05/28.