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3-(Trifluoroacetyl)indole

CAS 14618-45-2C10H6F3NOChemical Synthesis

3-(Trifluoroacetyl)indole (CAS: 14618-45-2; Formula: C10H6F3NO; Molar Mass: 213.16) is a trifluoromethyl ketone derivative of indole. This compound serves as a valuable building block in organic synthesis. Its primary applications include its use as a reactant in enantioselective synthesis of indoles, preparation of indolecarboxamides, and in the formation of Michael adducts via the Baylis-Hillman reaction.

IUPAC
3-Indolyl trifluoromethyl ketone
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3-(Trifluoroacetyl)indole (C10H6F3NO) — chemical structure, CAS 14618-45-2; Chemistry, fine chemical supplied by Tech Serve Solutions
Building BlocksC10Chemical SynthesisHeterocyclic Building BlocksIndoles
01 /Applications

Enantioselective Synthesis of Indoles

Utilised as a reactant in palladium-catalyzed kinetic asymmetrical alkylation for the enantioselective synthesis of indole derivatives.

Preparation of N-Pyridinyl Indolecarboxamides

Serves as a reactant in the preparation of N-pyridinyl indolecarboxamides through the amidation of aminopyridine derivatives with indolecarboxylic acid.

Synthesis of Mast Cell Tryptase Inhibitors

Functions as a reactant in the preparation of mast cell tryptase inhibitors, where amidation is a key synthetic step.

Baylis-Hillman Reaction

Acts as a reactant for the formation of Michael adducts, particularly through the Baylis-Hillman reaction.

Indolecarboxamide Formation

A reactant for the preparation of indolecarboxamides via haloform cleavage of (trifluoroacetyl)indole using lithium dialkylamides.

02 /Properties
Molecular weight213.16
Empirical formulaC10H6F3NO
Assay99%
Application• Reactant for enantioselective synthesis of indoles via palladium-catalyzed kinetic asymmetrical alkylation1• Reactant for preparation of N-pyridinyl indolecarboxamides via amidation of aminopyridine derivatives. with indolecarboxylic acid2• Reactant for preparation of mast cell tryptase inhibitors, starting from indoles; using amidation as the key step3• Reactant for formation of Michael adducts via Baylis-Hillman reaction4• Reactant for preparation of indolecarboxamides via haloform cleavage of (trifluoroacetyl)indole with lithium dialkylamides5
Melting point211-214 °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 equipmentdust mask type N95 (US), Eyeshields, Gloves
Water hazard class (WGK, DE)3
Hazard codes (EU)Xi
Risk statements (R)36/37/38
Safety statements (S)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
14618-45-2
MDL number
MFCD00182114
PubChem substance
24866420
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-(Trifluoroacetyl)indole used for?

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3-(Trifluoroacetyl)indole is used as a reactant in various organic synthesis applications, including enantioselective synthesis of indoles, preparation of indolecarboxamides, and in the Baylis-Hillman reaction.

What are the CAS number and molecular formula for 3-(Trifluoroacetyl)indole?

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The CAS number for 3-(Trifluoroacetyl)indole is 14618-45-2, and its molecular formula is C10H6F3NO.

What grade and purity does Tech Serve Solutions supply for 3-(Trifluoroacetyl)indole?

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Tech Serve Solutions supplies 3-(Trifluoroacetyl)indole with a purity of 99%. We do not represent this product as USP, BP, or EP grade.

How should 3-(Trifluoroacetyl)indole be handled safely?

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3-(Trifluoroacetyl)indole is a warning compound (GHS07) causing skin irritation (H315), serious eye irritation (H319), and respiratory irritation (H335). Handle with appropriate personal protective equipment including a dust mask (type N95), eyeshields, and gloves in a well-ventilated area. Avoid breathing dust.

Is 3-(Trifluoroacetyl)indole a controlled substance?

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The provided data does not indicate that 3-(Trifluoroacetyl)indole is a controlled substance.

How is 3-(Trifluoroacetyl)indole packed and exported?

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Tech Serve Solutions is a specialist global supplier and exporter of fine chemicals. Specific packing and export details are available upon request.

How can I request a sample or quote for 3-(Trifluoroacetyl)indole?

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To request a sample or quote for 3-(Trifluoroacetyl)indole, please contact our sales team through the website or direct inquiry channels.

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