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HomeProduct name list2,4,5-Trifluorobenzaldehyde

2,4,5-Trifluorobenzaldehyde

  • CAS NO.:165047-24-5
  • Empirical Formula: C7H3F3O
  • Molecular Weight: 160.09
  • MDL number: MFCD00061196
  • EINECS: 605-382-8
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2023-09-01 17:37:15
2,4,5-Trifluorobenzaldehyde Structural

What is 2,4,5-Trifluorobenzaldehyde?

Chemical properties

Clear colorless to light yellow liquid

The Uses of 2,4,5-Trifluorobenzaldehyde

2,4,5-Trifluorobenzaldehyde may be used in the synthesis of:

  • bis(2,4,5-trifluorophenyl)methanone
  • 8-phenyl-7-tosyl-1-(2,4,5-trifluorophenyl)octahydro-1H-pyrano[3,4-c] pyridine
  • (E)-4-methoxy-N′-(2,4,5-trifluorobenzylidene)-benzohydrazide monohydrate

The Uses of 2,4,5-Trifluorobenzaldehyde

It is a reactant in the enantioselective synthesis of (R)-selegiline, an anti-Parkinson's drug, (S)-benzphetamine, an anti-obesity agent, and (S)-sitagliptin, an anti-diabetic drug.

Properties of 2,4,5-Trifluorobenzaldehyde

Boiling point: 168 °C (lit.)
Density  1.408 g/mL at 25 °C (lit.)
refractive index  n20/D 1.482(lit.)
Flash point: 137 °F
storage temp.  under inert gas (nitrogen or Argon) at 2-8°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Liquid
color  Clear colorless to light yellow
Specific Gravity 1.408
Water Solubility  Not miscible or difficult to mix in water.
Sensitive  Air Sensitive
BRN  8479631
InChI InChI=1S/C7H3F3O/c8-5-2-7(10)6(9)1-4(5)3-11/h1-3H
CAS DataBase Reference 165047-24-5(CAS DataBase Reference)

Safety information for 2,4,5-Trifluorobenzaldehyde

Signal word Warning
Pictogram(s)
ghs
Flame
Flammables
GHS02
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H226:Flammable liquids
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
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 2,4,5-Trifluorobenzaldehyde

InChIKey CYIFJRXFYSUBFW-UHFFFAOYSA-N
SMILES C(=O)C1=CC(F)=C(F)C=C1F

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