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3-Bromo-4-chlorobenzotrifluoride

CAS 454-78-4BrC6H3(Cl)CF3Chemical Synthesis

3-Bromo-4-chlorobenzotrifluoride (CAS: 454-78-4; Formula: BrC6H3(Cl)CF3) is a trifluoromethylated aromatic compound with a molecular weight of 259.45 g/mol. This halogenated hydrocarbon serves as a valuable building block in organic synthesis, particularly for introducing the 3-bromo-4-chlorotrifluoromethylphenyl moiety into more complex molecules. Its specific structure makes it useful in the development of novel chemical entities across various research and industrial sectors.

IUPAC
3-Bromo-4-chloro-α,α,α-trifluorotoluene
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3-Bromo-4-chlorobenzotrifluoride (BrC6H3(Cl)CF3) — chemical structure, CAS 454-78-4; Chemistry, fine chemical supplied by Tech Serve Solutions
ArylBuilding BlocksChemical SynthesisHalogenated Hydrocarbons
01 /Applications

Organic Synthesis Intermediate

Utilised as a key building block in the synthesis of complex organic molecules. Its reactive sites allow for diverse chemical transformations, enabling the construction of targeted chemical structures.

Pharmaceutical Research

Serves as a precursor or intermediate in the development of new pharmaceutical compounds. The trifluoromethyl group can impart unique properties to drug candidates.

Agrochemical Development

Employed in the synthesis of potential agrochemicals, where halogenated aromatic structures are often incorporated for biological activity.

Materials Science

Can be used in the creation of specialised materials where its distinct chemical structure contributes to desired material properties.

02 /Properties
Molecular weight259.45
Linear formulaBrC6H3(Cl)CF3
Assay97%
Boiling point188-190 °C(lit.)
Density1.726 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.499(lit.)
Melting point−23-−22 °C(lit.)
03 /Safety & handling
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Warning

Hazard statements

  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements

  • P261Avoid breathing dust, fume, gas or vapours
  • P305IF IN EYES
Protective equipmentEyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point94 °C / 201.2 °F
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)36/37/38
Safety statements (S)26-37/39

Hazard information is provided for guidance. Always consult the product Safety Data Sheet (SDS), available on request, before handling.

04 /Identifiers & registry
CAS number
454-78-4
MDL number
MFCD00018093
PubChem substance
24862570
05 /Quality & supply

Documentation

Every batch ships with a Certificate of Analysis covering assay, identity and purity; the grade is confirmed against your enquiry. Safety Data Sheets and technical data sheets are available on request.

Supply & logistics

Samples for technical evaluation; bulk MOQ by grade and packaging. In-stock material ships in 7–10 working days, worldwide, with full export documentation.

06 /Frequently asked questions

What is 3-Bromo-4-chlorobenzotrifluoride used for?

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3-Bromo-4-chlorobenzotrifluoride is primarily used as a building block and intermediate in organic synthesis, with applications in pharmaceutical and agrochemical research, and potentially in materials science.

What are the CAS number and chemical formula for 3-Bromo-4-chlorobenzotrifluoride?

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The CAS number is 454-78-4 and the chemical formula is BrC6H3(Cl)CF3.

What grade and purity does Tech Serve Solutions supply for 3-Bromo-4-chlorobenzotrifluoride?

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Tech Serve Solutions supplies 3-Bromo-4-chlorobenzotrifluoride with an assay of 97%. This product is suitable for research and technical applications; TSS does not represent it as USP, BP, or EP grade.

What are the main hazards associated with 3-Bromo-4-chlorobenzotrifluoride?

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This compound is a warning signal word substance, identified with GHS07 symbol. It causes skin irritation (H315), serious eye irritation (H319), and may cause respiratory irritation (H335). Appropriate personal protective equipment, including eyeshields and suitable gloves, is essential when handling.

How is 3-Bromo-4-chlorobenzotrifluoride packed and exported?

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3-Bromo-4-chlorobenzotrifluoride is carefully packed according to international shipping regulations to ensure safe transit. TSS is experienced in exporting fine chemicals globally.

How can I request a quote or sample of 3-Bromo-4-chlorobenzotrifluoride?

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To request a quote or sample of 3-Bromo-4-chlorobenzotrifluoride, please contact our sales department via the website or by phone.

Need 3-Bromo-4-chlorobenzotrifluoride in a specific grade or volume?