• TCI F0957 1391728-13-4 1-Fluoro-3,3-dimethyl-1,2-benziodoxole
  • 1-Fluoro-3,3-dimethyl-1,2-benziodoxole (CAS 1391728-13-4) - TCI F0957 - AMI Scientific
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TCI

CAS 1391728-13-4

1-Fluoro-3,3-dimethyl-1,2-benziodoxole TCI F0957

1-Fluoro-3,3-dimethyl-1,2-benziodoxole TCI F0957

Chemical Identity

CAS No.
1391728-13-4
PubChem
CID 72546672·SID 253661001
Formula
C9H10FIO
Molecular weight
280.08 g/mol
Purity
>98.0%(T)
Storage
0-10°C
Full identifiers (IUPAC, SMILES, InChIKey)
IUPAC
1-fluoro-3,3-dimethyl-1lambda3,2-benziodoxole
SMILES
CC1(C2=CC=CC=C2I(O1)F)C
InChIKey
FISITPXJYDTLHI-UHFFFAOYSA-N
Rp 6.306.300,00
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1-Fluoro-3,3-dimethyl-1,2-benziodoxole is a synthetic reagent widely used in laboratory settings for its unique chemical properties. As a member of the hypervalent iodine compound family, it plays a crucial role in organic synthesis due to its high reactivity and oxidizing capabilities. This compound is commonly employed in oxidation and substitution reactions, making it an essential tool for chemists working on complex molecule synthesis. Its versatility allows it to be used as both a reagent and a catalyst, depending on the reaction conditions.

The compound's high reactivity is attributed to the presence of a hypervalent iodine atom, which enhances its ability to participate in various chemical transformations. Its stability under controlled conditions ensures safe handling and long-term storage, making it a reliable choice for laboratory use. The molecular structure of 1-Fluoro-3,3-dimethyl-1,2-benziodoxole contributes to its effectiveness in promoting chemical reactions, particularly those involving oxidation or functional group modification.

In Indonesian laboratories, this compound is frequently utilized in organic chemistry research, especially in the development of new compounds or the modification of existing ones. Its availability in suitable packaging and solid form makes it convenient for both research and teaching applications. Researchers in various institutions rely on this reagent for its consistent performance and reliability in synthetic processes.

Advantages (TCI brochure)

  • Moisture- and air-stable
  • Effective for 1,1-difluorination of styrene derivatives
  • Applicable to fluorinative intramolecular-cyclizations

TCI brochures (PDF)

Related TCI products

  • Organic synthesis reactions benefit from this compound's oxidizing properties, enabling the formation of complex organic molecules.
  • It is ideal for substitution reactions due to its high reactivity and ability to act as a versatile reagent.
  • In oxidation processes, the hypervalent iodine atom facilitates the conversion of functional groups, enhancing reaction efficiency.
  • It supports the development of new chemical compounds by providing a reliable and effective synthetic pathway.
  • This reagent is commonly used in academic and industrial research settings for its consistent performance in chemical transformations.

From the TCI brochure

  • Alpha-fluorinations of 1,3-dicarbonyl compounds
  • 1,1-difluorinations of styrene derivatives
  • Fluorinative intramolecular-cyclizations

Brand TCI
CAS number 1391728-13-4
Molecular formula —
Purity —
Category Chemistry > Synthetic Reagents > Hypervalent Iodine Compounds
Pack sizes Available in various sizes as per standard laboratory requirements
Physical form Solid
Storage Store in a cool, dry place away from light and moisture

Data from the TCI brochure

Ukuran kemasan1g

Source: TCI brochure RR056 (2025-06-03)

This compound should be stored in a cool, dry environment, away from direct light and moisture to maintain its stability and effectiveness. It is recommended to use airtight containers to prevent exposure to air and humidity. Due to its reactivity, it should be handled with care, using appropriate personal protective equipment such as gloves and safety goggles. Avoid contact with incompatible substances, and ensure proper ventilation in the laboratory. Proper storage and handling protocols help ensure the safety of laboratory personnel and the integrity of the compound during use.

References cited in the TCI brochure

  1. Gemma C. Geary. Electrophilic fluorination using a hypervalent iodine reagent derived from fluoride Chemical Communications, 2013. doi:10.1039/c3cc44792h
  2. Nadia O. Ilchenko. Mild Silver‐Mediated Geminal Difluorination of Styrenes Using an Air‐ and Moisture‐Stable Fluoroiodane Reagent Angewandte Chemie International Edition, 2014. doi:10.1002/anie.201408812
  3. Weiming Yuan. Catalytic Intramolecular Aminofluorination, Oxyfluorination, and Carbofluorination with a Stable and Versatile Hypervalent Fluoroiodine Reagent Angewandte Chemie International Edition, 2015. doi:10.1002/anie.201503373

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