53903-51-8

Basic information

• Product Name: 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL
• Synonyms: 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL;UKRORGSYN-BB BBV-5105736
• CAS NO: 53903-51-8
• Molecular Formula: C₇H₄ClF₃O
• Molecular Weight: 196.55
• EINECS: 1312995-182-4
• Mol File: 53903-51-8.mol
• Article Data: 9

Chemical Properties

• Boiling Point: 188.952°C at 760 mmHg
• Flash Point: 68.076°C
• Appearance: /
• Density: 1.474g/cm³
• Vapor Pressure: 0.422mmHg at 25°C
• Refractive Index: 1.482
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• PKA: 7.54±0.43(Predicted)
• CAS DataBase Reference: 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL(CAS DataBase Reference)
• NIST Chemistry Reference: 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL(53903-51-8)
• EPA Substance Registry System: 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL(53903-51-8)

Safety Data

• Hazardous Substances Data: 53903-51-8(Hazardous Substances Data)

Usage

General Description

4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL is a chemical compound with the molecular formula C7H4ClF3O. It is a phenolic compound that is derived from the substitution of a hydrogen atom on the phenol ring with a chlorine atom and a trifluoromethyl group. This chemical is commonly used as a building block in the synthesis of various pharmaceuticals and agrochemicals due to its diverse reactivity. It is also used as an intermediate in the production of other chemicals, including dyes, fragrances, and other organic compounds. 4-CHLORO-2-(TRIFLUOROMETHYL)PHENOL is a colorless to pale yellow liquid with a characteristic odor and is considered to be mildly toxic.

InChI:InChI=1/C7H4ClF3O/c8-4-1-2-6(12)5(3-4)7(9,10)11/h1-3,12H

Upstream product

• 445-03-4 4-chloro-2-(trifluoromethyl)aniline 
• 2926-29-6 Langlois reagent 
• 106-48-9 4-chloro-phenol 
• 1548-61-4 4-nitro-2-(trifluoromethyl)phenol 
• 1535-76-8 4-amino-2-(trifluoromethyl)phenol 
• 654-76-2 1-methoxy-4-nitro-2-(trifluoromethyl)benzene 
• 2314-97-8 iodotrifluoromethane 
• 320-50-3 1,4-dichloro-2-trifluoromethylbenzene 
• 89634-74-2 2-trifluoromethyl-4-chlorofluorobenzene 

Downstream Products

• 502623-72-5 dimethyl 4-chloro-2-(trifluoromethyl)phenyl phosphate 
• 1391980-14-5 3-(2-amino-5-(4-chloro-2-(trifluoromethyl)phenoxy)thiazol-4-yl)benzonitrile 
• 1391979-79-5 N-(5-(4-chloro-2-(trifluoromethyl)phenoxy)-4-(3-cyanophenyl)thiazol-2-yl)-2-(4-(ethylsulfonyl)phenyl)acetamide 
• 1402001-78-8 2-{2-[4-chloro-2-(trifluoromethyl)phenoxy]ethyl}-7-(4-methyl-1H-imidazol-1-yl)-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,6-dione 

Relevant articles and documents

Regioselective C-H Trifluoromethylation of Aromatic Compounds by Inclusion in Cyclodextrins

A regioselective radical C-H trifluoromethylation of aromatic compounds was developed using cyclodextrins (CDs) as additives. The C-H trifluoromethylation proceeded with high regioselectivity to afford the product in good yield, even on the gram scale. In the presence of CDs, some substrates underwent a single trifluoromethylation selectively, whereas mixtures of single- and double-trifluoromethylated products were formed in the absence of the CD. 1H NMR experiments indicated that the regioselectivity was controlled by the inclusion of a substrate inside the CD cavity.

COMPOUNDS USEFUL AS RETINOID-RELATED ORPHAN RECEPTOR GAMMA MODULATORS

Disclosed are retinoid-related orphan receptor gamma (RORγ) modulators of Formula (I) and their use in the treatment of diseases mediated by RORγ, wherein the radicals have the meanings as defined in the invention.

Syntheses and bioactivity of o- or p-trifluoromethylphenyl phosphates

o- and p-Trifluoromethylphenyl phosphates designed as mechanism-based phosphotyrosine phosphatase inactivators have been prepared. Some of them show herbicidal activities.