Cas no 57486-69-8 (Methyl 2-(2-bromophenyl)acetate)

Methyl 2-(2-bromophenyl)acetate is a brominated aromatic ester with the molecular formula C9H9BrO2. This compound is commonly utilized as an intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and fine chemicals. Its key advantages include high purity and stability, making it suitable for precise synthetic applications. The presence of both the ester and bromophenyl functional groups allows for versatile reactivity, enabling further modifications such as cross-coupling reactions or hydrolysis. The compound is typically supplied as a clear to pale-yellow liquid or solid, depending on storage conditions, and should be handled under inert atmospheres to prevent degradation. Its well-defined structure ensures reproducibility in research and industrial processes.
Methyl 2-(2-bromophenyl)acetate structure
57486-69-8 structure
Product Name:Methyl 2-(2-bromophenyl)acetate
CAS No:57486-69-8
MF:C9H9BrO2
MW:229.070562124252
MDL:MFCD07779430
CID:367065
PubChem ID:8063364
Update Time:2025-11-03

Methyl 2-(2-bromophenyl)acetate Chemical and Physical Properties

Names and Identifiers

    • Methyl 2-(2-bromophenyl)acetate
    • (2-Bromo-phenyl)-acetic acid methyl ester
    • Benzeneacetic acid,2-bromo-, methyl ester
    • Methyl 2-Bromophenylacetate
    • Methyl (2-bromophenyl)acetate
    • Methyl o-bromophenylacetate
    • (2-Bromo-phenyl)acetic acid methyl ester
    • 57486-69-8
    • AB3930
    • methyl2-Bromophenylacetate
    • PS-4851
    • methyl-2-bromophenylacetate
    • DTXSID00429055
    • FT-0640462
    • methyl(2-bromophenyl)acetate
    • BCP32367
    • 2-(4-Methyl-piperazine-1-carbonyl)-cyclohexanecarboxylicacid
    • SCHEMBL965852
    • Benzeneacetic acid,2-bromo-,methyl ester;2-Bromophenylacetic acid methyl ester
    • methyl 2-(2-bromophenyl)acetate, AldrichCPR
    • Q-102039
    • AKOS015835165
    • CS-W004685
    • Benzeneacetic acid, 2-bromo-, methyl ester
    • methyl alpha-bromophenyl acetate
    • 2-Bromo-benzeneacetic acid, methyl ester
    • SY023296
    • A8195
    • methyl ortho-bromophenylacetate
    • 2-bromophenylacetic acid methyl ester
    • AB42488
    • EN300-131588
    • MFCD07779430
    • AMVCFIFDMKEIRE-UHFFFAOYSA-N
    • (2-Bromophenyl)-acetic acid methyl ester
    • AM85825
    • DB-053059
    • MDL: MFCD07779430
    • Inchi: 1S/C9H9BrO2/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5H,6H2,1H3
    • InChI Key: AMVCFIFDMKEIRE-UHFFFAOYSA-N
    • SMILES: BrC1C=CC=CC=1CC(=O)OC

Computed Properties

  • Exact Mass: 227.97900
  • Monoisotopic Mass: 227.97859g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 159
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.4
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • Density: 1.445
  • Boiling Point: 264 oC
  • Flash Point: 114 oC
  • PSA: 26.30000
  • LogP: 2.16460

Methyl 2-(2-bromophenyl)acetate Security Information

Methyl 2-(2-bromophenyl)acetate Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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Methyl 2-(2-bromophenyl)acetate Production Method

Additional information on Methyl 2-(2-bromophenyl)acetate

Methyl 2-(2-bromophenyl)acetate (CAS No: 57486-69-8)

Methyl 2-(2-bromophenyl)acetate, also known by its CAS registry number 57486-69-8, is a versatile organic compound with significant applications in various fields of chemistry and material science. This compound, characterized by its brominated aromatic structure, has been the subject of extensive research due to its unique properties and potential uses in drug development, polymer synthesis, and advanced materials.

The molecular structure of Methyl 2-(2-bromophenyl)acetate consists of a bromine atom attached to a phenyl ring, which is further connected to an acetic acid methyl ester group. This arrangement imparts the compound with both aromatic stability and reactivity, making it a valuable intermediate in organic synthesis.

Recent studies have highlighted the role of Methyl 2-(2-bromophenyl)acetate in the development of novel therapeutic agents. Researchers have explored its potential as a precursor in the synthesis of bioactive compounds, particularly in the field of oncology and neurodegenerative diseases.

In terms of physical properties, Methyl 2-(2-bromophenyl)acetate exhibits a melting point of approximately [insert specific value], and a boiling point around [insert specific value]. Its solubility in common solvents such as dichloromethane and ethyl acetate makes it suitable for various chemical reactions under controlled conditions.

The synthesis of Methyl 2-(2-bromophenyl)acetate typically involves a Friedel-Crafts acylation reaction or other acylation techniques, where bromobenzene derivatives are reacted with appropriate acetylating agents under catalytic conditions.

One of the most promising areas of application for Methyl 2-(2-bromophenyl)acetate is in polymer science, where it serves as a building block for constructing advanced polymeric materials with tailored properties such as enhanced thermal stability and mechanical strength.

Moreover, recent advancements have demonstrated the use of Methyl 2-(2-bromophenyl)acetate in the creation of stimuli-responsive materials, which can change their properties in response to external stimuli like temperature or pH changes.

In conclusion, Methyl 2-(2-bromophenyl)acetate (CAS No: 57486-69-8) stands out as a critical compound with diverse applications across multiple disciplines. Its continued exploration in cutting-edge research ensures its relevance in advancing modern chemical sciences.

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