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HomeProduct name list3,3,3-Trifluoro-2,2-dimethylpropionic acid

3,3,3-Trifluoro-2,2-dimethylpropionic acid

3,3,3-Trifluoro-2,2-dimethylpropionic acid Structural

What is 3,3,3-Trifluoro-2,2-dimethylpropionic acid?

The Uses of 3,3,3-Trifluoro-2,2-dimethylpropionic acid

3,3,3-Trifluoro-2,2-dimethylpropanoic Acid, is an organic buliding blocks, that can be used in the synthesis of variety of pharmaceutical compounds, such as inhibitors.

Synthesis

Prepare a dry, clean 1L four-necked flask. 18g of 3,3,3-trifluoro-2,2-dimethylpropanenitrile was added to it, and 500 ml of a 5 mol/L sodium hydroxide aqueous solution was placed in the flask; stir well; the mixture was heated to a temperature of 90-100 ° C and refluxed overnight. The reaction was terminated until 3,3,3-trifluoro-2,2-dimethylpropanenitrile was completely reacted. Concentrated hydrochloric acid was used to adjust the pH to 1. Continue stirring for 30 minutes, Extracted with 50*3ml of dichloromethane; the organic layers were combined and concentrated to give a white solid (3,3,3-Trifluoro-2,2-dimethylpropionic acid). The yield was 84.3% (GC 98%).
3,3,3-Trifluoro-2,2-dimethylpropionic acid

Properties of 3,3,3-Trifluoro-2,2-dimethylpropionic acid

Melting point: 66-71 °C
Boiling point: 76-77°C/14mm
Density  1.278±0.06 g/cm3(Predicted)
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 3.10±0.10(Predicted)
color  White to Off-White
InChI InChI=1S/C5H7F3O2/c1-4(2,3(9)10)5(6,7)8/h1-2H3,(H,9,10)
CAS DataBase Reference 889940-13-0

Safety information for 3,3,3-Trifluoro-2,2-dimethylpropionic acid

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

Computed Descriptors for 3,3,3-Trifluoro-2,2-dimethylpropionic acid

InChIKey VMFSJVUPIXOCFO-UHFFFAOYSA-N
SMILES C(O)(=O)C(C)(C)C(F)(F)F

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