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Carbamic acid, diethyl-, 2,2,2-trifluoroethyl ester

CAS 326-94-3Formula C7H12F3NO2MW 199.17PubChem 10965508

2,2,2-Trifluoroethyl N,N-diethylcarbamate (CAS: 326-94-3) is a functionalized intermediate with the formula C7H12F3NO2. It serves as a valuable building block in organic synthesis, particularly for introducing trifluoromethyl and carbamate groups into target molecules. This compound is intended for research use only.

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InChIKey: BXNLMPJGXPPXST-UHFFFAOYSA-NC7H12F3NO2 | MW 199.17

Chemical Identity

Molecular Formula

C7H12F3NO2

Molecular Weight

199.17 g/mol

Exact Mass

199.082013

PubChem CID

10965508

IUPAC Name

2,2,2-trifluoroethyl N,N-diethylcarbamate

SMILES String

CCN(CC)C(=O)OCC(F)(F)F

Names & Synonyms

2,2,2-trifluoroethyl diethylcarbamateBXNLMPJGXPPXST-UHFFFAOYSA-N2,2,2-trifluoroethyldiethylcarbamate
External Identifiers
DTXSID20450063RefChem:332338DTXCID40400883SCHEMBL2924105MFCD20762940AKOS012027558SY319094

Catalog Overview

2,2,2-Trifluoroethyl N,N-diethylcarbamate, also known as Carbamic acid, diethyl-, 2,2,2-trifluoroethyl ester, is a functionalized intermediate with the chemical formula C7H12F3NO2. This compound features a trifluoroethyl group and a diethylcarbamate moiety, making it a versatile building block in organic synthesis. It is typically employed in research and development settings for the creation of more complex molecules, where the introduction of a trifluoromethyl group or a carbamate functionality is desired. Its unique structure allows for diverse applications in medicinal chemistry, agrochemical research, and materials science as...

Use Context

  • Research chemical sourcing
  • Custom synthesis and catalog availability review
  • COA, SDS, pricing, and fulfillment workflow
Read more catalog context

2,2,2-Trifluoroethyl N,N-diethylcarbamate, also known as Carbamic acid, diethyl-, 2,2,2-trifluoroethyl ester, is a functionalized intermediate with the chemical formula C7H12F3NO2. This compound features a trifluoroethyl group and a diethylcarbamate moiety, making it a versatile building block in organic synthesis. It is typically employed in research and development settings for the creation of more complex molecules, where the introduction of a trifluoromethyl group or a carbamate functionality is desired. Its unique structure allows for diverse applications in medicinal chemistry, agrochemical research, and materials science as a research-use-only chemical.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Colorless liquid

Physical State

Liquid

Melting Point

-20.0 °C

Boiling Point

200.0 °C

Density

1.24 g/cm³

Water Solubility

Slightly soluble

Flash Point

81.5 °C

Applications / Classifications

Research intermediateCustom synthesis building block

Biological Target Reference

No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.

Preliminary Safety-Style Reference

Preliminary

Preliminary safety-style information for reference only. Not a supplier SDS.

Handling and Storage
  • Handle 2,2,2-Trifluoroethyl N,N-diethylcarbamate in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat, to prevent skin and eye contact. Avoid inhalation of dust or vapors. In case of contact, wash thoroughly with soap and water. Store in a cool, dry place, away from incompatible materials. Always consult the Safety Data Sheet (SDS) for comprehensive safety information before use.

Related Products / Graph Discovery

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