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PDdB-Pfp

CAS 2101206-44-2Formula C17H14F5NO2S2MW 423.4PubChem 129896956

PDdB-Pfp is a research-use chemical with the molecular formula C17H14F5NO2S2 and a molecular weight of 423.40. It features a pentafluorophenyl ester and a pyridin-2-yldisulfanyl group, suggesting potential utility in chemical synthesis or as a probe in biochemical studies.

Loading RDKit molecule structure...
InChIKey: AYVZOOXFTJNGJZ-UHFFFAOYSA-NC17H14F5NO2S2 | MW 423.4

Chemical Identity

Molecular Formula

C17H14F5NO2S2

Molecular Weight

423.4 g/mol

Exact Mass

423.038612

PubChem CID

129896956

IUPAC Name

(2,3,4,5,6-pentafluorophenyl) 4-methyl-4-(pyridin-2-yldisulfanyl)pentanoate

SMILES String

CC(C)(CCC(=O)Oc1c(F)c(F)c(F)c(F)c1F)SSc1ccccn1

Names & Synonyms

Perfluorophenyl 4-methyl-4-(pyridin-2-yldisulfanyl)pentanoate2,3,4,5,6-pentafluorophenyl 4-methyl-4-(pyridin-2-yldisulfanyl)pentanoateT18527
External Identifiers
orb1987868SCHEMBL20740183BJD20644AKOS032946548HY-129372CS-0105069

Catalog Overview

PDdB-Pfp, also known by its CAS number 2101206-44-2, is a complex organic compound characterized by its (2,3,4,5,6-pentafluorophenyl) 4-methyl-4-(pyridin-2-yldisulfanyl)pentanoate structure. This molecule incorporates a highly fluorinated aromatic ring, a pentanoate ester linkage, and a disulfide bond connected to a pyridine moiety. Its structural features, particularly the pentafluorophenyl group, often impart unique reactivity and properties, making it a valuable reagent in synthetic organic chemistry, especially for derivatization or as a building block for more complex molecules. The disulfide bond may also be exploited in...

Use Context

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Read more catalog context

PDdB-Pfp, also known by its CAS number 2101206-44-2, is a complex organic compound characterized by its (2,3,4,5,6-pentafluorophenyl) 4-methyl-4-(pyridin-2-yldisulfanyl)pentanoate structure. This molecule incorporates a highly fluorinated aromatic ring, a pentanoate ester linkage, and a disulfide bond connected to a pyridine moiety. Its structural features, particularly the pentafluorophenyl group, often impart unique reactivity and properties, making it a valuable reagent in synthetic organic chemistry, especially for derivatization or as a building block for more complex molecules. The disulfide bond may also be exploited in redox-sensitive applications or for conjugation strategies. This compound is intended for Research Use Only (RUO).

Physical Data

Estimated

Estimated / predicted physical property values for catalog reference.

Appearance

White solid

Physical State

Solid

Melting Point

105.0 °C

Boiling Point

380.0 °C

Density

1.45 g/cm³

Water Solubility

Insoluble

Flash Point

220.0 °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 PDdB-Pfp in a well-ventilated area or fume hood. Wear appropriate personal protective equipment, including gloves, eye protection, and a lab coat. Avoid inhalation, ingestion, and skin contact. In case of exposure, refer to the Safety Data Sheet (SDS) for specific first-aid measures. Store in a cool, dry place, away from incompatible materials. Dispose of waste in accordance with local regulations. This chemical is for research use only and not for human or animal consumption.

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