Active Chemical RecordCatalog PreviewCatalog ready

2,2,2-trifluoroethyl N-(prop-2-en-1-yl)carbamate

CAS 1240527-16-5Formula C6H8F3NO2MW 183.13PubChem 47002895

2,2,2-trifluoroethyl N-(prop-2-en-1-yl)carbamate is a fluorinated carbamate derivative featuring both a trifluoroethyl ester and an allyl group. This compound serves as a versatile functionalized intermediate in organic synthesis, particularly useful for introducing trifluoroethyl and allyl functionalities into target molecules for research applications.

Loading RDKit molecule structure...
InChIKey: ZTMVEWXRERMAJE-UHFFFAOYSA-NC6H8F3NO2 | MW 183.13

Chemical Identity

Molecular Formula

C6H8F3NO2

Molecular Weight

183.13 g/mol

Exact Mass

183.050713

PubChem CID

47002895

IUPAC Name

2,2,2-trifluoroethyl N-prop-2-enylcarbamate

SMILES String

C=CCNC(=O)OCC(F)(F)F

Names & Synonyms

2,2,2-Trifluoroethyl allylcarbamateH411202,2,2-trifluoroethylN-(prop-2-en-1-yl)carbamateZ976725044
External Identifiers
QZB52716MFCD16547531AKOS011633668CS-0252909EN300-61990

Catalog Overview

2,2,2-trifluoroethyl N-(prop-2-en-1-yl)carbamate, identified by CAS 1240527-16-5, is an organic compound with the molecular formula C6H8F3NO2 and a molecular weight of 183. 13 g/mol. It is characterized by a carbamate linkage, where the nitrogen is substituted with an allyl (prop-2-en-1-yl) group and the oxygen is esterified with a 2,2,2-trifluoroethyl group. The presence of the trifluoromethyl group imparts unique electronic and steric properties, often enhancing lipophilicity and metabolic stability in derived compounds.

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-(prop-2-en-1-yl)carbamate, identified by CAS 1240527-16-5, is an organic compound with the molecular formula C6H8F3NO2 and a molecular weight of 183.13 g/mol. It is characterized by a carbamate linkage, where the nitrogen is substituted with an allyl (prop-2-en-1-yl) group and the oxygen is esterified with a 2,2,2-trifluoroethyl group. The presence of the trifluoromethyl group imparts unique electronic and steric properties, often enhancing lipophilicity and metabolic stability in derived compounds. The allyl group provides a reactive alkene functionality, enabling various addition reactions, cross-coupling reactions, and other transformations in synthetic routes. This makes it a valuable building block for the synthesis of complex organic molecules, including potential pharmaceutical intermediates and agrochemicals, within a research-use context.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

Clear, colorless liquid

Physical State

Liquid

Melting Point

-10.0 °C

Boiling Point

190.0 °C

Density

1.25 g/cm³

Water Solubility

Slightly soluble

Flash Point

75.0 °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-(prop-2-en-1-yl)carbamate 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. Consult the Safety Data Sheet (SDS) for detailed hazard information and emergency procedures before use. This product is for research use only and not for human or animal consumption.

Related Products / Graph Discovery

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

Similar products (text references)

120200-04-6CAS 120200-04-6
2792-72-5CAS 2792-72-5
2228118-66-7CAS 2228118-66-7

Recommended application cues

Research intermediateCustom synthesis building block

Catalog discovery cues, not supplier-verified claims.

Related HS Code / Compliance

HS Code: 292419GHS 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.