2,3,6-TRIFLUOROPHENOL

Base Information

• Chemical Name: 2,3,6-TRIFLUOROPHENOL
• CAS No.: 113798-74-6
• Molecular Formula: C6H3 F3 O
• Molecular Weight: 148.084
• Hs Code.: 29081000
• Mol file: 113798-74-6.mol

Synonyms:2,3,6-Trifluorophenol

Chemical Property of 2,3,6-TRIFLUOROPHENOL

Chemical Property:

• Appearance/Colour: clear light yellow liquid after melting
• Vapor Pressure: 5.81mmHg at 25°C
• Melting Point: 33-37 °C(lit.)
• Boiling Point: 137°Cat760mmHg
• PKA: 6.45±0.15(Predicted)
• Flash Point: 59°C
• PSA: 20.23000
• Density: 1.473g/cm³
• LogP: 1.80950
• Storage Temp.: 2-8°C
• Water Solubility.: Soluble in water (47.267 mg/L est.)

Purity/Quality:

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

2,3,6-Trifluorophenol ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36/37/39-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Uses: 2,3,6-Trifluorophenol may be employed as model compound to investigate the site-selective functionalization of halogen-bearing phenols by organometallic approach.

Technology Process of 2,3,6-TRIFLUOROPHENOL

There total 2 articles about 2,3,6-TRIFLUOROPHENOL 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:

2,3,5-trifluoro-4-hydroxybenzoic acid (156839-10-0) → 2,3,6-trifluorophenol (113798-74-6)

Guidance literature:

With sulfuric acid; In 1-methyl-pyrrolidin-2-one; water;

Reference yield:

1,2,3,4-tetrafluorobenzene (551-62-2) → 2,3,6-trifluorophenol (113798-74-6)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; for 4h; Heating;

Reference yield: 100.0%

1-bromo-hexane (111-25-1) + 2,3,6-trifluorophenol (113798-74-6) → C12H15F3O

Guidance literature:

With potassium tert-butylate; In N,N-dimethyl-formamide; at 20 ℃;

upstream raw materials:

1,2,3,4-tetrafluorobenzene

2,3,5-trifluoro-4-hydroxybenzoic acid

Downstream raw materials:

2',3',6'-trifluoro-phenyl 1,6-dimethoxyacridine-9-carboxylate

Acridine-9-carboxylic acid 2,3,6-trifluoro-phenyl ester

3-Methoxy-acridine-9-carboxylic acid 2,3,6-trifluoro-phenyl ester

1,6-Dimethoxy-4-methyl-acridine-9-carboxylic acid 2,3,6-trifluoro-phenyl ester

Refernces

• 1、 Allen, Kim J.,Bolton, Roger,Williams, Gareth H.. "Homolytic Reactions of Polyfluoroaromatic Compounds. Part 16. Competitive Phenylation of Polyfluorobenzenes". . p. 691 - 696. Retrieved 2007/10/02.