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Tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate is a chemical compound characterized by its molecular formula C8H14BrFNO2. It is a bromomethyl derivative of 3-fluoroazetidine-1-carboxylic acid, featuring a tert-butyl group attached to the azetidine ring. tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate is recognized for its structural versatility, particularly due to the presence of bromomethyl and fluoro groups, which facilitate the introduction of functional groups in organic molecules.

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  • 1374658-83-9 Structure
  • Basic information

    1. Product Name: tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate
    2. Synonyms: tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate;1-Boc-3-bromomethyl-3-fluoroazetidine
    3. CAS NO:1374658-83-9
    4. Molecular Formula: C9H15BrFNO2
    5. Molecular Weight: 268.13
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1374658-83-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 284.3±25.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.42±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: -5.19±0.40(Predicted)
    10. CAS DataBase Reference: tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate(CAS DataBase Reference)
    11. NIST Chemistry Reference: tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate(1374658-83-9)
    12. EPA Substance Registry System: tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate(1374658-83-9)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1374658-83-9(Hazardous Substances Data)

1374658-83-9 Usage

Uses

Used in Organic Synthesis:
Tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate serves as a valuable building block in organic synthesis, contributing to the creation of a diverse range of bioactive molecules. Its unique structure allows for the development of complex organic compounds through various chemical reactions.
Used in Pharmaceutical Research:
In the pharmaceutical industry, tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate is utilized for the preparation of pharmaceutical drugs. Its ability to introduce functional groups makes it instrumental in the synthesis of new drug candidates with potential therapeutic applications.
Used in Agrochemical Development:
tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate also finds application in the agrochemical sector, where it is employed in the synthesis of bioactive molecules for use in crop protection and pest management. Its versatility aids in the development of novel agrochemicals with improved efficacy and selectivity.
Used in Material Science:
Tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate holds potential in the field of material science, where it may contribute to the development of new materials with unique properties. Its structural features can be leveraged to create materials with specific characteristics for various applications.
Used in Chemical Catalysis:
tert-butyl 3-(bromomethyl)-3-fluoroazetidine-1-carboxylate's reactivity and functional group introduction capabilities make it a candidate for use in chemical catalysis. It can potentially enhance the efficiency of catalytic processes, leading to more sustainable and effective chemical reactions.

Check Digit Verification of cas no

The CAS Registry Mumber 1374658-83-9 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,3,7,4,6,5 and 8 respectively; the second part has 2 digits, 8 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 1374658-83:
(9*1)+(8*3)+(7*7)+(6*4)+(5*6)+(4*5)+(3*8)+(2*8)+(1*3)=199
199 % 10 = 9
So 1374658-83-9 is a valid CAS Registry Number.

1374658-83-9Downstream Products

1374658-83-9Relevant articles and documents

Synthesis of sp 3-Enriched β-Fluoro Sulfonyl Chlorides

Gurbanov, Rustam,Sokolov, Andriy,Golovach, Sergey,Melnykov, Kostiantyn,Dobrydnev, Alexey V.,Grygorenko, Oleksandr O.

, p. 1771 - 1784 (2021)

A three-step approach to the synthesis of sp 3-enriched β-fluoro sulfonyl chlorides starting from alkenes is reported. The method was successfully applied to a wide range of acyclic and cyclic substrates, bearing either an exocyclic or an endocyclic double bond. The procedure worked with a wide range of substrates and tolerated a number of functional and protecting groups. Moreover, the target cyclic compounds were obtained as single cis diastereomers on a multigram scale. The title compounds are promising building blocks for drug discovery that can be used to obtain sp 3-enriched β-fluoro and α,β-unsaturated sulfonamides.

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