Fluoroacetyl chloride

Base Information

• Chemical Name: Fluoroacetyl chloride
• CAS No.: 359-06-8
• Molecular Formula: C2H2ClFO
• Molecular Weight: 96.4887
• Hs Code.: 2915900090
• European Community (EC) Number: 206-623-6
• UN Number: 2810,1752
• UNII: 0CQX1ANG4H
• DSSTox Substance ID: DTXSID4059885
• Nikkaji Number: J55.073F
• Wikipedia: Fluoroacetyl_chloride
• Wikidata: Q1434179
• Mol file: 359-06-8.mol

Synonyms:FLUOROACETYL CHLORIDE;359-06-8;2-fluoroacetyl chloride;Acetyl chloride, fluoro-;HSDB 6327;Chlorid kyseliny fluoroctove [Czech];EINECS 206-623-6;UNII-0CQX1ANG4H;TL 670;0CQX1ANG4H;Chlorid kyseliny fluoroctove;Acetyl chloride, 2-fluoro-;BRN 1739051;fluoracetyl chloride;C2H2ClFO;C2-H2-Cl-F-O;DTXSID4059885;FLUOROACETYL CHLORIDE [HSDB];MFCD00015738;TL-670;AKOS015853783;FT-0600307;Q1434179

Chemical Property of Fluoroacetyl chloride

Chemical Property:

• Appearance/Colour: Liquid
• Vapor Pressure: 294mmHg at 25°C
• Refractive Index: 1.352
• Boiling Point: 49.766 °C at 760 mmHg
• Flash Point: -16.1 °C
• PSA: 17.07000
• Density: 1.278 g/cm³
• LogP: 0.72130
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 95.9778205
• Heavy Atom Count: 5
• Complexity: 44.9
• Transport DOT Label: Poison

Purity/Quality:

99% ^*data from raw suppliers

Fluoroacetyl chloride, 99% 99% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 14-26-35
• Safety Statements: 3/7-9-38-45-53

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Toxic Gases & Vapors -> Acid Halides
• Canonical SMILES: C(C(=O)Cl)F

Technology Process of Fluoroacetyl chloride

There total 6 articles about Fluoroacetyl 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: 83.0%

sodium fluoroacetate (62-74-8) → monofluoroacetyl chloride (359-06-8)

Guidance literature:

With Phthaloyl dichloride; Heating;

DOI:10.1002/ijch.199900023

Reference yield: 80.0%

Fluoroacetic acid (144-49-0) → monofluoroacetyl chloride (359-06-8)

Guidance literature:

With phosphorus pentachloride; at 80 ℃; for 1h;

DOI:10.1002/ejoc.201301614

Reference yield:

→ monofluoroacetyl chloride (359-06-8)

Guidance literature:

With phosphorus pentachloride;

DOI:10.1021/ja01188a524

upstream raw materials:

Fluoroacetic acid

Benzotrichlorid

sodium fluoroacetate

Phthaloyl dichloride

Downstream raw materials:

fluoro-acetic acid-[2]pyridylamide

2-fluoro-1-(4-fluorophenyl)ethanone

1-(4-bromophenyl)-2-fluoroethan-1-one

fluoro-acetic acid-(2-fluoro-ethyl ester)

Refernces

• 1、 Miscevic, S.,Minic, D.,Petrovic, S.. "Synthesis of some new N-monosubstituted fluoroacetamides". . p. 239 - 247. Retrieved 1992.
• 2、 Truce. "-". . p. 2828. Retrieved 1948.
• 3、 Yang, Ling,Zhang, Xiya,Shen, Dongshuai,Yu, Xuezhi,Li, Yuan,Wen, Kai,Shen, Jianzhong,Wang, Zhanhui. "Hapten design and monoclonal antibody to fluoroacetamide, a small and highly toxic chemical". . p. 1 - 12. Retrieved 2020/07/08.
• 4、 Albler, Christopher,Schmid, Walther. "Synthetic routes towards fluorine-containing amino sugars: Synthesis of fluorinated analogues of tomosamine and 4-amino-4-deoxyarabinose". . p. 2451 - 2459. Retrieved 2014/05/06.