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3-Fluorobenzotrifluoride

CAS 401-80-9FC6H4CF3Chemical Synthesis

3-Fluorobenzotrifluoride (CAS: 401-80-9; Formula: FC6H4CF3) is a fluorinated aromatic compound with a molecular weight of 164.10. This chemical serves as a valuable building block and solvent in organic synthesis. Its utility is demonstrated in research involving electrogenerated chemiluminescence and as a precursor in the preparation of other complex organic molecules through reactions such as nitration. Tech Serve Solutions offers this compound with a high purity of 99%.

IUPAC
α,α,α,3-Tetrafluorotoluene
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3-Fluorobenzotrifluoride (FC6H4CF3) — chemical structure, CAS 401-80-9; Chemistry, fine chemical supplied by Tech Serve Solutions
ArylBuilding BlocksChemical SynthesisFluorinated Building BlocksHalogenated HydrocarbonsOrganic Building Blocks
01 /Applications

Fluorinated Aromatic Solvent

3-Fluorobenzotrifluoride has been employed as a solvent in scientific investigations, notably for studying the electrogenerated chemiluminescence of compounds such as 9,10-diphenylanthracene, rubrene, and anthracene.

Chemical Synthesis Intermediate

This compound is utilised in synthetic organic chemistry. For example, it has been used in the preparation of 2-nitro-5-fluorobenzotrifluoride through a nitration reaction, showcasing its role as a key intermediate.

Building Block for Organic Molecules

As a fluorinated aromatic building block, 3-Fluorobenzotrifluoride is integral to the construction of more complex organic structures, particularly those requiring specific fluorination patterns.

02 /Properties
Molecular weight164.10
Linear formulaFC6H4CF3
Assay99%
Boiling point101-102 °C(lit.)
Density1.302 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.4(lit.)
Application3-Fluorobenzotrifluoride was used:• as fluorinated aromatic solvent to investigate electrogenerated chemiluminescence of 9,10-diphenylanthracene, rubrene and anthracene1• used to preparae 2-nitro-5-fluorobenzotrifluoride via nitration reaction2
03 /Safety & handling
GHS hazard pictogram: Flammable (GHS02)
Flammable
GHS hazard pictogram: Harmful / irritant (GHS07)
Harmful / irritant
Danger

Hazard statements

  • H225Highly flammable liquid and vapour
  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H335May cause respiratory irritation

Precautionary statements

  • P210Keep away from heat, sparks and open flames. No smoking
  • P261Avoid breathing dust, fume, gas or vapours
  • P305IF IN EYES
Protective equipmentEyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point7 °C / 44.6 °F
Transport (UN / ADR)UN 1993BF 3 / PGII
Water hazard class (WGK, DE)3
Hazard codes (EU)F,Xi
Risk statements (R)11-36/37/38
Safety statements (S)16-26-36

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

04 /Identifiers & registry
CAS number
401-80-9
MDL number
MFCD00000382
PubChem substance
24853124
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-Fluorobenzotrifluoride used for?

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3-Fluorobenzotrifluoride is used as a fluorinated aromatic solvent for investigating electrogenerated chemiluminescence and as a precursor in chemical synthesis, for example, to prepare 2-nitro-5-fluorobenzotrifluoride.

What is the CAS number and chemical formula for 3-Fluorobenzotrifluoride?

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The CAS number for 3-Fluorobenzotrifluoride is 401-80-9, and its linear formula is FC6H4CF3.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies 3-Fluorobenzotrifluoride with an assay of 99%. We do not represent this product as USP, BP, or EP grade.

How should 3-Fluorobenzotrifluoride be handled safely?

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3-Fluorobenzotrifluoride is a highly flammable liquid and vapour (H225) and can cause skin irritation (H315), serious eye irritation (H319), and respiratory irritation (H335). Handle with appropriate personal protective equipment, including eyeshields, gloves, and respiratory protection, in a well-ventilated area away from ignition sources.

Is 3-Fluorobenzotrifluoride exported by Tech Serve Solutions?

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Yes, Tech Serve Solutions is a global supplier and exporter of fine chemicals, including 3-Fluorobenzotrifluoride.

How can I request a quote or sample?

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To request a quote or a sample of 3-Fluorobenzotrifluoride, please contact our sales department through the TSS website or by phone.

Need 3-Fluorobenzotrifluoride in a specific grade or volume?