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Hexafluoroisopropyl methyl carbonate

CAS 607382-52-5Formula C5H4F6O3MW 226.07PubChem 57315532

Hexafluoroisopropyl methyl carbonate (CAS 607382-52-5) is a fluorinated organic compound with the formula C5H4F6O3 and a molecular weight of 226.07. It is primarily utilized in research and development as a chemical intermediate or building block, particularly in the synthesis of novel fluorinated compounds.

Loading RDKit molecule structure...
InChIKey: XIRMSPZXBKNQNO-UHFFFAOYSA-NC5H4F6O3 | MW 226.07

Chemical Identity

Molecular Formula

C5H4F6O3

Molecular Weight

226.07 g/mol

Exact Mass

226.006463

PubChem CID

57315532

IUPAC Name

1,1,1,3,3,3-hexafluoropropan-2-yl methyl carbonate

SMILES String

COC(=O)OC(C(F)(F)F)C(F)(F)F

Names & Synonyms

XIRMSPZXBKNQNO-UHFFFAOYSA-NMethyl 2,2,2-trifluoro-1-(trifluoromethyl)ethyl carbonatemethyl [2,2,2-trifluoro-1-(trifluoromethyl)ethyl] carbonate
External Identifiers
MFCD28334384SCHEMBL17958378DB-430727

Catalog Overview

Hexafluoroisopropyl methyl carbonate, identified by CAS number 607382-52-5, is a synthetic organic chemical featuring a hexafluoroisopropyl group esterified with a methyl carbonate moiety. With a molecular formula of C5H4F6O3 and a molecular weight of 226. 07 g/mol, this compound is characterized by its high fluorine content, which can impart unique chemical and physical properties to derived molecules. It serves as a versatile reagent in organic synthesis, especially in the introduction of fluorinated functionalities into complex molecular structures.

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Read more catalog context

Hexafluoroisopropyl methyl carbonate, identified by CAS number 607382-52-5, is a synthetic organic chemical featuring a hexafluoroisopropyl group esterified with a methyl carbonate moiety. With a molecular formula of C5H4F6O3 and a molecular weight of 226.07 g/mol, this compound is characterized by its high fluorine content, which can impart unique chemical and physical properties to derived molecules. It serves as a versatile reagent in organic synthesis, especially in the introduction of fluorinated functionalities into complex molecular structures. Researchers may explore its utility in various synthetic pathways, including the preparation of pharmaceuticals, agrochemicals, and advanced materials where fluorination is a key modification.

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

colorless liquid

Physical State

liquid

Melting Point

-70.0 °C

Boiling Point

150.0 °C

Density

1.5 g/cm³

Water Solubility

slightly soluble

Flash Point

45.0 °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 Hexafluoroisopropyl methyl carbonate 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. Consult the Safety Data Sheet (SDS) for comprehensive safety information and emergency procedures before use. Store in a cool, dry place, away from incompatible materials.

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