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2,2,2-trifluoroethyl N-(3-chloro-2-methylphenyl)carbamate

CAS 1087797-97-4Formula C10H9ClF3NO2MW 267.63PubChem 39871420

This compound is a trifluoroethyl carbamate derivative featuring a 3-chloro-2-methylphenyl moiety. With a molecular formula of C10H9ClF3NO2 and a molecular weight of 267.63, it is classified as a research-oriented/research-oriented molecule, making it suitable for various synthetic and medicinal chemistry research applications.

Loading RDKit molecule structure...
InChIKey: NALORJFUWIEXBQ-UHFFFAOYSA-NC10H9ClF3NO2 | MW 267.63

Chemical Identity

Molecular Formula

C10H9ClF3NO2

Molecular Weight

267.63 g/mol

Exact Mass

267.027391

PubChem CID

39871420

SMILES String

Cc1c(Cl)cccc1NC(=O)OCC(F)(F)F

Names & Synonyms

2,2,2-trifluoroethyl 3-chloro-2-methylphenylcarbamate2,2,2-trifluoroethylN-(3-chloro-2-methylphenyl)carbamate
External Identifiers
MTB79797AKOS005875100EN300-88268

Catalog Overview

2,2,2-Trifluoroethyl N-(3-chloro-2-methylphenyl)carbamate, identified by CAS 1087797-97-4, is an organic chemical compound with the molecular formula C10H9ClF3NO2 and a molecular weight of 267. 63 g/mol. It features a carbamate functional group linking a 2,2,2-trifluoroethyl moiety to a 3-chloro-2-methylphenyl group. This structure suggests its potential utility as a building block or intermediate in the synthesis of more complex molecules, particularly within pharmaceutical or agrochemical research due to its "druglike_bioactive_like" structural characteristics.

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-(3-chloro-2-methylphenyl)carbamate, identified by CAS 1087797-97-4, is an organic chemical compound with the molecular formula C10H9ClF3NO2 and a molecular weight of 267.63 g/mol. It features a carbamate functional group linking a 2,2,2-trifluoroethyl moiety to a 3-chloro-2-methylphenyl group. This structure suggests its potential utility as a building block or intermediate in the synthesis of more complex molecules, particularly within pharmaceutical or agrochemical research due to its "druglike_bioactive_like" structural characteristics. Its trifluoromethyl and chloro substituents can impart specific electronic and steric properties, influencing reactivity and biological interactions.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

95.0 °C

Boiling Point

280.0 °C

Density

1.4 g/cm³

Water Solubility

Slightly soluble

Flash Point

160.0 °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 with appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Use in a well-ventilated area or under a fume hood to avoid inhalation. Avoid contact with skin and eyes. In case of contact, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult the Safety Data Sheet (SDS) for detailed hazard information and safe handling procedures.

Related Products / Graph Discovery

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

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.