Cas no 22913-24-2 (Methyl Benzobthiophene-2-carboxylate)

Methyl Benzothiophene-2-carboxylate is a versatile organic compound primarily used as an intermediate in pharmaceutical and agrochemical synthesis. Its benzothiophene core structure imparts stability and reactivity, making it valuable for constructing complex heterocyclic systems. The methyl ester group enhances solubility in organic solvents, facilitating further functionalization. This compound is particularly useful in the development of active pharmaceutical ingredients (APIs) due to its compatibility with various coupling and derivatization reactions. High purity grades are available to meet stringent industry standards, ensuring consistent performance in research and production. Its well-characterized properties and reliable synthetic pathways make it a preferred choice for medicinal chemistry applications.
Methyl Benzobthiophene-2-carboxylate structure
22913-24-2 structure
Product Name:Methyl Benzobthiophene-2-carboxylate
CAS No:22913-24-2
MF:C10H8O2S
MW:192.234321594238
MDL:MFCD00067791
CID:52170
PubChem ID:2800344
Update Time:2025-06-28

Methyl Benzobthiophene-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl benzo[b]thiophene-2-carboxylate
    • Benzo[b]thiophene-2-carboxylic acid methyl ester~Methyl thianaphthene-2-carboxylate~Thianaphthene-2-carboxylic acid methyl ester
    • methyl 1-benzothiophene-2-carboxylate
    • 2-methoxycarbonylbenzo[b]thiophene
    • Benzo[b]thiophen-2-carbonsaeure-methylester
    • Benzo[b]thiophene-2-carboxylic acid methyl ester,Methyl thianaphthene-2-carboxylate
    • benzo[b]thiophene-2-carboxylic acid,methyl ester
    • methyl benzothiophene-2-carboxylate
    • Methyl thianaphthene-2-carboxylate
    • Benzo[b]thiophene-2-carboxylic acid methyl ester
    • Benzo[b]thiophene-2-carboxylic acid, methyl ester
    • KRRAZMUPVIGDCU-UHFFFAOYSA-N
    • Methyl benzo(b)thiophene-2-carboxylate
    • Benzo(b)thiophene-2-carboxylic acid methyl ester
    • Maybridge1_001812
    • HMS546K08
    • SBB091
    • FT-0628702
    • SY006828
    • DS-4162
    • 22913-24-2
    • GEO-00287
    • MFCD00067791
    • CS-0043114
    • W-200236
    • AKOS000280413
    • EN300-193090
    • SCHEMBL700108
    • Methyl benzo[b]thiophene-2-carboxylate, 97%
    • CHEMBL560931
    • DTXSID50384160
    • ALBB-024206
    • DB-046017
    • 2-methoxycarbonyl benzothiophene
    • STK736357
    • Methyl Benzobthiophene-2-carboxylate
    • MDL: MFCD00067791
    • Inchi: 1S/C10H8O2S/c1-12-10(11)9-6-7-4-2-3-5-8(7)13-9/h2-6H,1H3
    • InChI Key: KRRAZMUPVIGDCU-UHFFFAOYSA-N
    • SMILES: S1C(C(=O)OC)=CC2C=CC=CC1=2
    • BRN: 142166

Computed Properties

  • Exact Mass: 192.02500
  • Monoisotopic Mass: 192.025
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 205
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3.1
  • Topological Polar Surface Area: 54.5

Experimental Properties

  • Color/Form: Undetermined 2. density (g/ml, 25/4 ℃)
  • Density: 1.273
  • Melting Point: 70-74?°C
  • Boiling Point: 304.586℃/760mmHg
  • Flash Point: 138℃
  • Refractive Index: 1.638
  • PSA: 54.54000
  • LogP: 2.68790

Methyl Benzobthiophene-2-carboxylate Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305 + P351 + P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26
  • Hazardous Material Identification: Xi
  • Storage Condition:Sealed in dry,2-8°C
  • Risk Phrases:R36/37/38
  • Safety Term:S22;S24/25

Methyl Benzobthiophene-2-carboxylate Customs Data

  • HS CODE:2934999090
  • Customs Data:

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Methyl Benzobthiophene-2-carboxylate Production Method

Methyl Benzobthiophene-2-carboxylate Suppliers

Amadis Chemical Company Limited
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(CAS:22913-24-2)Methyl Benzobthiophene-2-carboxylate
Order Number:A816419
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 05:05
Price ($):482.0

Methyl Benzobthiophene-2-carboxylate Related Literature

Additional information on Methyl Benzobthiophene-2-carboxylate

Methyl Benzobthiophene-2-carboxylate: A Comprehensive Overview

Methyl Benzobthiophene-2-carboxylate, also known by its CAS number CAS 22913-24-2, is a compound of significant interest in various scientific and industrial applications. This compound belongs to the class of benzobthiophene derivatives, which have been extensively studied due to their unique chemical properties and potential applications in materials science, pharmaceuticals, and optoelectronics. In this article, we will delve into the structural characteristics, synthesis methods, physical properties, and recent advancements in the utilization of Methyl Benzobthiophene-2-carboxylate.

The molecular structure of Methyl Benzobthiophene-2-carboxylate comprises a benzobthiophene core with a methyl ester group attached at the 2-position. The benzobthiophene moiety is a fused bicyclic system consisting of a benzene ring and a thieno[3,4-b]pyrrole ring. This structure imparts the compound with unique electronic properties, making it an attractive candidate for various applications. The presence of the methyl ester group further enhances its reactivity and solubility, which are crucial for its use in chemical synthesis and material applications.

Recent studies have focused on the synthesis of Methyl Benzobthiophene-2-carboxylate through various routes, including direct esterification and coupling reactions. These methods have been optimized to improve yield and purity, ensuring that the compound can be produced on a larger scale for industrial applications. Researchers have also explored the use of catalytic systems to facilitate the synthesis process, reducing reaction times and energy consumption.

The physical properties of Methyl Benzobthiophene-2-carboxylate are critical for its application in different fields. For instance, its melting point and boiling point are essential parameters for determining its suitability in thermal processes. Additionally, its solubility in various solvents has been studied to understand its behavior in different chemical environments. These properties are often tailored through modifications to the molecular structure, enabling the compound to be adapted for specific uses.

In terms of applications, Methyl Benzobthiophene-2-carboxylate has shown promise in the development of advanced materials. For example, it has been used as a precursor for synthesizing conducting polymers and organic semiconductors. These materials are integral to modern electronics, including flexible displays and wearable devices. Furthermore, research into its application in drug delivery systems has revealed potential benefits due to its biocompatibility and controlled release properties.

Recent advancements in nanotechnology have also highlighted the potential of Methyl Benzobthiophene-2-carboxylate as a building block for constructing nanostructured materials. Its ability to form self-assembled monolayers has been leveraged in creating surfaces with tailored functionalities, such as anti-fouling or catalytic properties. These developments underscore the versatility of this compound across multiple disciplines.

The environmental impact of using Methyl Benzobthiophene-2-carboxylate has also been a topic of interest among researchers. Studies have been conducted to assess its biodegradability and toxicity under various conditions. Understanding these aspects is crucial for ensuring sustainable practices in its production and application.

In conclusion, Methyl Benzobthiophene-2-carboxylate (CAS 22913-24-2) is a multifaceted compound with a wide range of applications across different scientific domains. Its unique chemical structure and tunable properties make it an invaluable tool for researchers and industry professionals alike. As ongoing research continues to uncover new potentials for this compound, it is poised to play an increasingly significant role in shaping future technologies.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:22913-24-2)Methyl Benzobthiophene-2-carboxylate
A816419
Purity:99%
Quantity:100g
Price ($):482.0
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