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2,2,2-trifluoroethyl N-(2,3-dimethylphenyl)carbamate

CAS 1087788-57-5Formula C11H12F3NO2MW 247.21PubChem 39871411

2,2,2-trifluoroethyl N-(2,3-dimethylphenyl)carbamate is a fluorinated carbamate derivative with a molecular formula of C11H12F3NO2 and a molecular weight of 247.21 g/mol. This compound is intended for research use as a functionalized intermediate in synthetic chemistry.

Loading RDKit molecule structure...
InChIKey: ONWRZQPIGJOUGY-UHFFFAOYSA-NC11H12F3NO2 | MW 247.21

Chemical Identity

Molecular Formula

C11H12F3NO2

Molecular Weight

247.21 g/mol

Exact Mass

247.082013

PubChem CID

39871411

SMILES String

Cc1cccc(NC(=O)OCC(F)(F)F)c1C

Names & Synonyms

2,2,2-trifluoroethyl 2,3-dimethylphenylcarbamateG392502,2,2-trifluoroethylN-(2,3-dimethylphenyl)carbamateZ381542132
External Identifiers
MTB78857AKOS009102171EN300-88263

Catalog Overview

2,2,2-trifluoroethyl N-(2,3-dimethylphenyl)carbamate, identified by CAS 1087788-57-5 and PubChem CID 39871411, is a chemical compound featuring a trifluoroethyl group and a 2,3-dimethylphenylcarbamate moiety. Its structure, represented by the SMILES string Cc1cccc(NC(=O)OCC(F)(F)F)c1C, suggests potential utility in organic synthesis, particularly in the introduction of trifluoroethyl and carbamate functionalities into target molecules. As a functionalized intermediate, it may serve as a building block for synthesizing more complex compounds in pharmaceutical, agrochemical, or materials science research. Researchers should consult...

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-(2,3-dimethylphenyl)carbamate, identified by CAS 1087788-57-5 and PubChem CID 39871411, is a chemical compound featuring a trifluoroethyl group and a 2,3-dimethylphenylcarbamate moiety. Its structure, represented by the SMILES string Cc1cccc(NC(=O)OCC(F)(F)F)c1C, suggests potential utility in organic synthesis, particularly in the introduction of trifluoroethyl and carbamate functionalities into target molecules. As a functionalized intermediate, it may serve as a building block for synthesizing more complex compounds in pharmaceutical, agrochemical, or materials science research. Researchers should consult relevant literature for specific applications and reaction conditions.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White crystalline solid

Physical State

Solid

Melting Point

95.0 °C

Boiling Point

300.0 °C

Density

1.35 g/cm³

Water Solubility

Slightly soluble

Flash Point

155.0 °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-(2,3-dimethylphenyl)carbamate in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including safety goggles, gloves, and a lab coat. Avoid inhalation, ingestion, and skin contact. In case of contact, rinse thoroughly with water. Store in a cool, dry place, away from incompatible materials. Always refer to the Safety Data Sheet (SDS) for comprehensive safety information before use.

Related Products / Graph Discovery

Related products, derivatives, keywords, and application cues for catalog discovery.

Similar products (text references)

1391274-41-1CAS 1391274-41-1
1214098-81-3CAS 1214098-81-3

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 292429GHS Pictograms: GHS07Shipment review: Shipment details require review before fulfillment.

Compliance cues are non-linked reference tags and require shipment review.

Catalog navigation

Other public CAS pages in this catalog. These links support navigation across additional intermediates and do not imply equivalence, availability, or shared use.