4-(Trifluoromethoxy)benzylamine

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4-(Trifluoromethoxy)benzylamine Basic information
Product Name:4-(Trifluoromethoxy)benzylamine
Synonyms:1-[4-(TRIFLUOROMETHOXY)PHENYL]METHANAMINE;P-TRIFLUOROMETHOXYBENZYL AMINE;RARECHEM AL BW 0449;4-(Trifluoromethoxy)benzylamine 97%;4-(Trifluoromethoxy)benzylamine97%;[4-(Trifluoromethoxy)phenyl]methylamine;4-(Trifluoromethoxy)benzenemethanamine;[4-(Trifluoromethoxy)phenyl]methylamine, 4-(Aminomethyl)-alpha,alpha,alpha-trifluoroanisole
CAS:93919-56-3
MF:C8H8F3NO
MW:191.15
EINECS:300-040-1
Product Categories:Fluorine series;Amine;Amines;C8;Nitrogen Compounds
Mol File:93919-56-3.mol
4-(Trifluoromethoxy)benzylamine Structure
4-(Trifluoromethoxy)benzylamine Chemical Properties
Boiling point 57-60 °C10 mm Hg(lit.)
density 1.252 g/mL at 25 °C(lit.)
refractive index n20/D 1.452(lit.)
Fp 172 °F
storage temp. under inert gas (nitrogen or Argon) at 2–8 °C
pka8.75±0.10(Predicted)
form Liquid
Specific Gravity1.252
color Clear colorless to light yellow
Sensitive Air Sensitive
BRN 8200624
InChI1S/C8H8F3NO/c9-8(10,11)13-7-3-1-6(5-12)2-4-7/h1-4H,5,12H2
InChIKeyDBGROTRFYBSUTR-UHFFFAOYSA-N
SMILESNCc1ccc(OC(F)(F)F)cc1
CAS DataBase Reference93919-56-3(CAS DataBase Reference)
Safety Information
Hazard Codes Xi,C
Risk Statements 36/37/38
Safety Statements 26-36/37/39-37/39
RIDADR UN2735
WGK Germany 3
Hazard Note Corrosive
HazardClass 8
PackingGroup III
HS Code 29222990
Storage Class10 - Combustible liquids
Hazard ClassificationsEye Irrit. 2
Skin Irrit. 2
STOT SE 3
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
4-(Trifluoromethoxy)benzylamine Usage And Synthesis
Chemical Propertiesclear colorless to light yellow liquid
Uses4-(Trifluoromethoxy)benzylamine may be used in chemical synthesis.
Synthesis
4-(Trifluoromethoxy)benzonitrile

332-25-2

4-(TRIFLUOROMETHOXY)BENZYLAMINE

93919-56-3

A tetrahydrofuran (30 mL) solution of 4-(trifluoromethoxy)benzyl cyanide (5.0 g, 26.72 mmol) was slowly added dropwise to a tetrahydrofuran (30 mL) solution of lithium aluminum tetrahydroxide (3.0 g, 88.44 mmol) at 0 °C. After the dropwise addition was completed, the reaction mixture was warmed to room temperature and stirred for 3 hours. Upon completion of the reaction, the mixture was cooled to 4 °C and diluted with tetrahydrofuran (50 mL). Subsequently, the reaction was quenched by sequentially adding water (3 mL), 15% sodium hydroxide solution (3 mL) and water (3 mL). After quenching, the mixture was stirred at room temperature for 15 minutes. The mixture was filtered through diatomaceous earth and the filtrate was dried with anhydrous magnesium sulfate. Finally, the filtrate was concentrated under reduced pressure to give 4-(trifluoromethoxy)benzylamine (3.1 g, 61% yield).

References[1] Patent: WO2017/139414, 2017, A1. Location in patent: Paragraph 00215-00216
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