2,3,5,6-Tetrafluorobenzoyl chloride

Base Information

• Chemical Name: 2,3,5,6-Tetrafluorobenzoyl chloride
• CAS No.: 107535-73-9
• Molecular Formula: C7H Cl F4 O
• Molecular Weight: 212.531
• Hs Code.: 29163990
• European Community (EC) Number: 677-578-1
• DSSTox Substance ID: DTXSID10370089
• Wikidata: Q82157408
• Mol file: 107535-73-9.mol

Synonyms:2,3,5,6-Tetrafluorobenzoyl chloride;107535-73-9;2,3,5,6-Tetrafluorobenzoylchloride;Benzoyl chloride,2,3,5,6-tetrafluoro-;SCHEMBL1019991;DTXSID10370089;AELMDUZWKHVPIF-UHFFFAOYSA-N;MFCD02093505;AKOS023118469;5-CARBOXYPYRIDINE-3-BORONICACID;BS-42234;FT-0609427;T1856;1-chlorocarbonyl-2,3,5,6-tetrafluorobenzene;A801721

Chemical Property of 2,3,5,6-Tetrafluorobenzoyl chloride

Chemical Property:

• Appearance/Colour: clear colorless liquid
• Vapor Pressure: 1.35mmHg at 25°C
• Refractive Index: 1.4645-1.4665
• Boiling Point: 172.1°C at 760 mmHg
• Flash Point: 57.9°C
• PSA: 17.07000
• Density: 1.59
• LogP: 2.62200
• Sensitive.: Moisture Sensitive
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 211.9652050
• Heavy Atom Count: 13
• Complexity: 199

Purity/Quality:

97% ^*data from raw suppliers

2,3,5,6-Tetrafluorobenzoylchloride 95+% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 36/37-34
• Safety Statements: 45-36/37/39-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=C(C(=C1F)F)C(=O)Cl)F)F

Technology Process of 2,3,5,6-Tetrafluorobenzoyl chloride

There total 3 articles about 2,3,5,6-Tetrafluorobenzoyl 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%

2,3,5,6-tetrafluorobenzoic acid (652-18-6) → 2,3,5,6-tetrafluorobenzoic acid chloride (107535-73-9)

Guidance literature:

With thionyl chloride; In N,N-dimethyl-formamide; at 70 ℃;

Reference yield: 92.0%

2,3,5,6-C6F4HCCl3 (181183-63-1) → 2,3,5,6-tetrafluorobenzoic acid chloride (107535-73-9)

Guidance literature:

With iron(III) chloride; at 70 ℃; for 2h; Temperature;

Reference yield:

1,2,4,5-Tetrafluorobenzene (327-54-8) → 2,3,5,6-tetrafluorobenzoic acid chloride (107535-73-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminum (III) chloride / tetrachloromethane / 2 h / 70 °C

2: iron(III) chloride / 2 h / 70 °C

With aluminum (III) chloride; iron(III) chloride; In tetrachloromethane;

upstream raw materials:

2,3,5,6-tetrafluorobenzoic acid

2,3,5,6-C₆F₄HCCl₃

1,2,4,5-Tetrafluorobenzene