453-77-0

Basic information

• Product Name: 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL
• Synonyms: 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL
• CAS NO: 453-77-0
• Molecular Formula: C₈H₆F₃NO₃
• Molecular Weight: 221.13
• Mol File: 453-77-0.mol
• Article Data: 16

Chemical Properties

• Melting Point: 50.6-52.2 °C
• Boiling Point: 289.0±40.0 °C(Predicted)
• Appearance: /
• Density: 1.486±0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• PKA: 11.20±0.10(Predicted)
• CAS DataBase Reference: 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL(CAS DataBase Reference)
• NIST Chemistry Reference: 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL(453-77-0)
• EPA Substance Registry System: 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL(453-77-0)

Safety Data

• Statements: 36/37/38
• Safety Statements: 26-36/37/39
• HazardClass: IRRITANT
• Hazardous Substances Data: 453-77-0(Hazardous Substances Data)

Usage

General Description

2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL is a chemical compound with the molecular formula C8H6F3NO3. It is a synthetic organic compound that contains fluorine, nitro, and hydroxyl functional groups. 2,2,2-TRIFLUORO-1-(3-NITROPHENYL)-ETHANOL is commonly used in the pharmaceutical and agricultural industries as a building block for the synthesis of various other compounds. Its unique chemical structure and functional groups make it useful for the production of drugs, pesticides, and other specialty chemicals. Additionally, it can also be used as a solvent and reagent in chemical reactions. However, it is important to handle this compound with caution, as it may have hazardous properties.

Upstream product

• 99-61-6 3-nitro-benzaldehyde 
• 81290-20-2 (trifluoromethyl)trimethylsilane 
• 431-46-9 2,2,2-trifluoro-1-methoxy-ethanol 
• 98-95-3 nitrobenzene 
• 657-15-8 2,2,2-trifluoro-1-(3-nitrophenyl)ethanone 

Downstream Products

• 1960-27-6 m,m'-dinitro-α,α,α-trifluoroacetophenone 
• 100664-17-3 m-nitro-α-trifluoromethylbenzyldichlorophosphate 
• 657-15-8 2,2,2-trifluoro-1-(3-nitrophenyl)ethanone 
• 1135312-07-0 (R)-2,2,2-trifluoro-1-(3'-nitrophenyl)ethanol 
• 1135311-92-0 (S)-2,2,2-trifluoro-1-(3'-nitrophenyl)ethyl isobutyrate 
• 1135312-27-4 2,2,2-trifluoro-1-(3'-nitrophenyl)ethyl isobutyrate 
• 2192-30-5 1-(3,5-dinitrophenyl)-2,2,2-trifluoroethan-1-ol 
• 105436-15-5 1-nitro-3-(1,2,2-trifluorovinyl)benzene 
• 71885-06-8 ((R)-1-Naphthalen-1-yl-ethyl)-carbamic acid (S)-2,2,2-trifluoro-1-(3-nitro-phenyl)-ethyl ester 
• 71927-76-9 ((R)-1-Naphthalen-1-yl-ethyl)-carbamic acid (R)-2,2,2-trifluoro-1-(3-nitro-phenyl)-ethyl ester 
• 100664-08-2 bis(2,2,2-trifluoroethyl) (m-nitro-α-trifluoromethylbenzyl) phosphate 

Relevant articles and documents

NAD(P)+-NAD(P)H MODEL. 40. EFFECT OF WATER ON THE RATE OF REDUCTION

Effect of water on catalytic activity of magnesium ion in the reduction with an NAD(P)H-model has been studied.It is concluded that small amount of water does not effect the catalytic activity.

Oxidation of α-trifluoromethyl and non-fluorinated alcohols: Via the merger of oxoammonium cations and photoredox catalysis

We present an alcohol oxidation strategy to access α-trifluoromethyl ketones (TFMKs) merging catalytic oxoammonium cation oxidation with visible-light photoredox catalysis. This work uses 4-acetamido-(2,2,6,6-tetramethyl-piperidin-1-yl)oxyl as an organic oxidant capable of generating TFMKs in good yields. The methodology serves as an improvement over previous reports of an analogous oxidation strategy requiring superstoichiometric quantities of oxidant. Both primary and secondary non-fluorinated alcohols can also be oxidised in good yields.

Highly efficient synthesis of aryl and heteroaryl trifluoromethyl ketones via o-iodobenzoic acid (IBX)

A two-step process for the synthesis of aryl and heteroaryl trifluoromethyl ketones from the corresponding aldehydes is described. Trifluoromethyl alcohols were prepared from aryl and heteroaryl aldehydes in excellent yields using catalytic amount of K2CO3. The trifluoromethyl alcohols were then oxidized conveniently and efficiently by o-iodoxybenzoic acid (IBX) under mild conditions to get the desired functionalized aryl and heteroaryl trifluoromethyl ketones.