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HomeProduct name list2,4,6-Trichlorobenzoic acid

2,4,6-Trichlorobenzoic acid

  • CAS NO.:50-43-1
  • Empirical Formula: C7H3Cl3O2
  • Molecular Weight: 225.46
  • MDL number: MFCD00060699
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-07-11 17:04:31
2,4,6-Trichlorobenzoic acid Structural

What is 2,4,6-Trichlorobenzoic acid?

Chemical properties

beige to light brown crystalline powder

The Uses of 2,4,6-Trichlorobenzoic acid

2,4,6-Trichlorobenzoic acid can be used as reactant involved in Active-sodium-promoted reductive cleavage of halogenated benzoic acids; Synthesis of aryl aminopyrazole benzamides for use as non-steroidal selective glucocorticoid receptor agonists ; Flame retardant monomer synthesis; Synthesis of 3,4,7-trisubstituted coumarins for use as antifungals and Solid-phase synthesis of saphenamycin analogs with antimicrobial activity.

The Uses of 2,4,6-Trichlorobenzoic acid

2,4,6-Trichlorobenzoic Acid is a possible degradation intermediate of Polychlorinated Biphenyls (PCBs) in contaminated soil, suggesting the occurrence of microbial transformation processes over time.

The Uses of 2,4,6-Trichlorobenzoic acid

Reactant involved in:

  • Active-sodium-promoted reductive cleavage of halogenated benzoic acids
  • Synthesis of aryl aminopyrazole benzamides for use as non-steroidal selective glucocorticoid receptor agonists
  • Flame retardant monomer synthesis
  • Synthesis of 3,4,7-trisubstituted coumarins for use as antifungals
  • Solid-phase synthesis of saphenamycin analogs with antimicrobial activity

Cocatalyst for cis-dihydroxylation and epoxidation of alkenes

General Description

Structure and hydrogen bonding pattern in 2,4,6-trichlorobenzoic acid is reported.

Properties of 2,4,6-Trichlorobenzoic acid

Melting point: 160-164 °C (lit.)
Boiling point: 329.7±37.0 °C(Predicted)
Density  1.5599 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  powder to crystal
pka 1.40±0.25(Predicted)
color  White to Light yellow to Light orange
BRN  1874127
CAS DataBase Reference 50-43-1(CAS DataBase Reference)
NIST Chemistry Reference Benzoic acid, 2,4,6-trichloro-(50-43-1)
EPA Substance Registry System 2,4,6-Trichlorobenzoic acid (50-43-1)

Safety information for 2,4,6-Trichlorobenzoic 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.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

Computed Descriptors for 2,4,6-Trichlorobenzoic acid

InChIKey RAFFVQBMVYYTQS-UHFFFAOYSA-N

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