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
External Identifiers
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
EstimatedEstimated / 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
Biological Target Reference
No verified biological target assignment. This compound is listed primarily as a research or synthetic intermediate.
Preliminary Safety-Style Reference
PreliminaryPreliminary 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.
Related products and analog discovery will be available as catalog graph data is expanded.