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4-Ethynyl-α,α,α-trifluorotoluene

CAS 705-31-7HC≡CC6H4CF3Chemical Synthesis

4-Ethynyl-α,α,α-trifluorotoluene (CAS: 705-31-7) is a halogenated organic building block with the linear formula HC≡CC₆H₄CF₃ and a molecular weight of 170.13 g/mol. This compound is primarily utilised in chemical synthesis, particularly for the development of self-assembled monolayers (SAMs). Its alkynyl and trifluoromethyl functionalities offer unique reactivity for various organic chemistry applications.

Synonyms
705-31-7, HC&#8801CC6H4CF3
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4-Ethynyl-α,α,α-trifluorotoluene (HC≡CC6H4CF3) — chemical structure, CAS 705-31-7; Chemistry, fine chemical supplied by Tech Serve Solutions
AlkynylBuilding BlocksChemical SynthesisHalogenated HydrocarbonsOrganic Building Blocks
01 /Applications

Organic Synthesis

Serves as a versatile building block in organic synthesis, enabling the construction of complex molecules. The presence of both an ethynyl group and a trifluoromethyl group provides distinct chemical handles for further functionalization.

Materials Science

Utilised in the synthesis of self-assembled monolayers (SAMs). These ordered molecular assemblies can be applied to surfaces to modify their properties, relevant in fields like surface science and nanotechnology.

Research and Development

A valuable reagent for academic and industrial research, facilitating studies in areas requiring alkynyl and fluorinated aromatic compounds.

02 /Properties
Molecular weight170.13
Linear formulaHC≡CC6H4CF3
Assay97%
Boiling point78-80 °C/2 mmHg(lit.)
Density1.043 g/mL at 25 °C(lit.)
Refractive indexn20/D 1.4650(lit.)
ApplicationUsed to synthesize self-assembled monolayers (SAMs).1
03 /Safety & handling
GHS hazard pictogram: Flammable (GHS02)
Flammable
Danger

Hazard statements

  • H225Highly flammable liquid and vapour

Precautionary statements

  • P210Keep away from heat, sparks and open flames. No smoking
Protective equipmentEyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Flash point20 °C / 68 °F
Transport (UN / ADR)UN 1993BE 3 / PGII
Water hazard class (WGK, DE)3
Hazard codes (EU)F
Risk statements (R)11
Safety statements (S)16-26-36-45

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

04 /Identifiers & registry
CAS number
705-31-7
MDL number
MFCD01861903
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 4-Ethynyl-α,α,α-trifluorotoluene used for?

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4-Ethynyl-α,α,α-trifluorotoluene is used in chemical synthesis, notably for the preparation of self-assembled monolayers (SAMs).

What is the CAS number and formula for 4-Ethynyl-α,α,α-trifluorotoluene?

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The CAS number is 705-31-7 and the linear formula is HC≡CC₆H₄CF₃.

What grade and purity does Tech Serve Solutions supply?

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Tech Serve Solutions supplies 4-Ethynyl-α,α,α-trifluorotoluene with an assay of 97%. We do not represent this product as meeting USP, BP, or EP pharmacopoeia standards.

How is 4-Ethynyl-α,α,α-trifluorotoluene handled and stored safely?

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This compound is a flammable liquid and vapour (H225) requiring significant precautions. Store away from heat, sparks, and open flames. Use only in a well-ventilated area. Appropriate personal protective equipment, including eyeshields, gloves, and respiratory protection, is essential during handling.

How is this chemical exported and shipped?

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4-Ethynyl-α,α,α-trifluorotoluene is shipped internationally under UN 1993, Hazard Class 3, Packing Group II regulations for flammable liquids.

How can I request a quote or sample?

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To request a quote or sample of 4-Ethynyl-α,α,α-trifluorotoluene, please contact our sales team through the website or by phone.

Need 4-Ethynyl-α,α,α-trifluorotoluene in a specific grade or volume?