Chemical Identity
Molecular Formula
C12H14F3NO2
Molecular Weight
261.24 g/mol
Exact Mass
261.097663
PubChem CID
39871533
IUPAC Name
2,2,2-trifluoroethyl N-(4-propan-2-ylphenyl)carbamate
SMILES String
CC(C)c1ccc(NC(=O)OCC(F)(F)F)cc1
Names & Synonyms
External Identifiers
Catalog Overview
2,2,2-trifluoroethyl N-[4-(propan-2-yl)phenyl]carbamate is an organic compound with the molecular formula C12H14F3NO2 and a molecular weight of 261. 24 g/mol. It is characterized by a trifluoroethyl ester group linked via a carbamate to a 4-isopropylphenyl group. This chemical structure suggests potential utility in synthetic organic chemistry, particularly in the synthesis of novel compounds or as a building block in medicinal chemistry research.
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-[4-(propan-2-yl)phenyl]carbamate is an organic compound with the molecular formula C12H14F3NO2 and a molecular weight of 261.24 g/mol. It is characterized by a trifluoroethyl ester group linked via a carbamate to a 4-isopropylphenyl group. This chemical structure suggests potential utility in synthetic organic chemistry, particularly in the synthesis of novel compounds or as a building block in medicinal chemistry research. Its trifluoromethyl group can impart unique physicochemical properties, such as increased lipophilicity and metabolic stability, which are often explored in drug discovery and agrochemical development.
Physical Data
EstimatedEstimated / predicted physical property values for catalog reference.
Appearance
White crystalline solid
Physical State
Solid
Melting Point
95.0 °C
Boiling Point
290.0 °C
Density
1.35 g/cm³
Water Solubility
Slightly soluble
Flash Point
172.0 °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-[4-(propan-2-yl)phenyl]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, rinse immediately with plenty of water. Store in a cool, dry place, away from incompatible materials. Consult 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.
Related CAS / Similar Products
Recommended application cues
Catalog discovery cues, not supplier-verified claims.
Related HS Code / Compliance
Compliance cues are non-linked reference tags and require shipment review.