683-98-7

Basic information

• Product Name: METHYL BROMODIFLUOROACETATE
• Synonyms: METHYL BROMODIFLUOROACETATE;Bromo(difluoro)acetic acid methyl ester;Methyl 2-broMo-2,2-difluoroacetate;Bromo(difluoro)acetic acid methyl ester, Methyl 2-bromo-2,2-difluoroethanoate
• CAS NO: 683-98-7
• Molecular Formula: C₃H₃BrF₂O₂
• Molecular Weight: 188.96
• Mol File: 683-98-7.mol

Chemical Properties

• Boiling Point: 97-98°C
• Flash Point: 6.6°C
• Appearance: /
• Density: 1.7125 g/cm3 (23℃)
• Vapor Pressure: 64.1mmHg at 25°C
• Refractive Index: 1.3880 (589.3 nm 23℃)
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: METHYL BROMODIFLUOROACETATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL BROMODIFLUOROACETATE(683-98-7)
• EPA Substance Registry System: METHYL BROMODIFLUOROACETATE(683-98-7)

Safety Data

• Hazard Codes: Xi
• RIDADR: 2924
• HazardClass: IRRITANT
• PackingGroup: II
• Hazardous Substances Data: 683-98-7(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
METHYL BROMODIFLUOROACETATE is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to facilitate the creation of complex organic molecules that are otherwise challenging to produce.
Used in Agrochemical Industry:
In the agrochemical sector, METHYL BROMODIFLUOROACETATE is utilized as a reagent in the development of compounds that aid in crop protection and enhancement of agricultural yields.
Used in Fine Chemicals Production:
METHYL BROMODIFLUOROACETATE is employed as an essential component in the production of fine chemicals, where its unique properties contribute to the formation of high-value specialty products.
Used in Fluoroorganic Compounds Manufacturing:
METHYL BROMODIFLUOROACETATE is also used as a precursor in the manufacture of fluoroorganic compounds, which have a wide range of applications across different industries due to their unique properties, such as enhanced stability and reactivity.

InChI:InChI=1/C3H3BrF2O2/c1-8-2(7)3(4,5)6/h1H3

Upstream product

• 3222-05-7 methyl tribromoacetate 
• 67-56-1 methanol 
• 430-85-3 1,1-dibromo-2,2-difluoroethylene 
• 107-31-3 Methyl formate 
• 3832-48-2 bromodifluoroacetyl chloride 
• 124745-25-1 1,1-difluoro-2,2-diphenylthioethylene 
• 37746-78-4 4-bromo-trans-crotonic acid ethyl ester 
• 109872-87-9 methyl difluoroiodoacetate 
• 100-39-0 benzyl bromide 
• 84509-61-5 2-((4-bromobut-3-yn-1-yl)oxy)-tetrahydro-2H-pyran 
• 123771-68-6 poly-{(methyl difluoroacetate)copper} 
• 558-57-6 1,2-dibromo-1,1-dichloro-2,2-difluoroethane 

Downstream Products

• 401-75-2 trifluoromethylcyclohexane 
• 120316-00-9 (S)-1-Benzyl-4-((S)-2,2-dimethyl-[1,3]dioxolan-4-yl)-3,3-difluoro-azetidin-2-one 
• 120316-01-0 (R)-1-Benzyl-4-((S)-2,2-dimethyl-[1,3]dioxolan-4-yl)-3,3-difluoro-azetidin-2-one 
• 120316-05-4 1-Benzyl-3,3-difluoro-4-((E)-propenyl)-azetidin-2-one 
• 89942-12-1 (E)/(Z)-1-bromo-1-heptene 
• 109872-88-0 (E)-2,2-Difluoro-non-3-enoic acid methyl ester 
• 120316-04-3 3,3-Difluoro-4-phenyl-1-((S)-1-phenyl-ethyl)-azetidin-2-one 
• 2314-97-8 iodotrifluoromethane 
• 74-88-4 methyl iodide 
• 1184-76-5 difluorodiiodomethane 
• 120316-02-1 1-phenyl-3,3-difluoro-4-phenyl-2-azetidinone 
• 420-46-2 2,2,2-trifluoroethanol 
• 116470-64-5 1,3-Dinitro-2,5-bis-trifluoromethyl-benzene 
• 651-94-5 α,α,α-trifluoro-2,4,6-trinitrotoluene 

Relevant articles and documents

Photo-triggered self-catalyzed fluoroalkylation/cyclization of unactivated alkenes: Synthesis of quinazolinones containing the CF2R group

A novel photo-triggered self-catalyzed fluoroalkylation/cyclization of quinazolinones containing unactivated alkenes with various fluoroalkyl bromides has been developed. This transformation exhibits excellent substrate generality with respect to both the coupling partners. Of note is that this is the first example describing the Csp3-Br bond homolysis of alkyl bromides via a substrate (quinazolinones) induced energy transfer process. Additionally, the mild conditions, tolerance to a wide range of functional groups and operational simplicity make this protocol practical for the synthesis of fluorine-containing ring-fused quinazolinones. This journal is

Ozone oxidation process of preparing a halogenated acetic acid and esters thereof (by machine translation)

The invention belongs to the field of chemical synthesis, in particular to a halogenated acetic acid or a halogenated acetic acid ester compound preparation method; halogenated ethane (type I) by ozone oxidation after the reaction, the reaction with water or alcohol to obtain a halogenated acetic acid or halogenated acetate (type II). (by machine translation)

Electrophilic addition reactions of 1,1-difluoro-2,2-diphenylthioethylene

Electrophiles have been shown to add to F2C=C(SPh)2 at the difluoromethylene carbon, indicating that sulfur is better able to stabilize a positive charge than fluorine.

(METHYL DIFLUOROACETATE)COPPER REAGENT. REMARKABLE SOLVENT EFFECT ON THE 19F-NMR SPECTRUM, STABILITY AND REACTIVITY

The 19F-NMR spectrum, thermal stability and reactivity of (methyl difluoroacetate)copper reagent were found to differ remarkably depending on the solvent (DMSO, DMF, or HMPA) used.With allylic bromide or alkynyl halide a crucial solvent effect for the coupling reactions was observed.