Cas no 380336-99-2 (4-Formyl-2-methoxyphenyl cyclopropanecarboxylate)

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate structure
380336-99-2 structure
Product Name:4-Formyl-2-methoxyphenyl cyclopropanecarboxylate
CAS No:380336-99-2
MF:C12H12O4
MW:220.221283912659
MDL:MFCD01935794
CID:92825
PubChem ID:735524
Update Time:2025-11-02

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate Chemical and Physical Properties

Names and Identifiers

    • 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate
    • (4-formyl-2-methoxyphenyl) cyclopropanecarboxylate
    • Cyclopropanecarboxylic acid 4-formyl-2-methoxy-phenyl ester
    • VS-03914
    • SR-01000260317
    • 380336-99-2
    • SR-01000260317-1
    • 4-FORMYL-2-METHOXYPHENYLCYCLOPROPANECARBOXYLATE
    • DTXSID10352800
    • CS-0307469
    • EN300-01063
    • F83595
    • MFCD01935794
    • AKOS000115358
    • FT-0730805
    • SCHEMBL19900210
    • Z56820986
    • DB-030430
    • BBL013653
    • STK408906
    • ALBB-001406
    • MDL: MFCD01935794
    • Inchi: 1S/C12H12O4/c1-15-11-6-8(7-13)2-5-10(11)16-12(14)9-3-4-9/h2,5-7,9H,3-4H2,1H3
    • InChI Key: ZHAOJSWBZLZTFK-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C=O)=CC=1OC)C(C1CC1)=O

Computed Properties

  • Exact Mass: 220.07400
  • Monoisotopic Mass: 220.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 5
  • Complexity: 272
  • 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: 1.6
  • Topological Polar Surface Area: 52.6?2

Experimental Properties

  • Color/Form: powder
  • Density: 1.28
  • Boiling Point: 332.8°Cat760mmHg
  • Flash Point: 146.9°C
  • Refractive Index: 1.59
  • PSA: 52.60000
  • LogP: 1.82310
  • Solubility: Not determined

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate Customs Data

  • HS CODE:2916209090
  • Customs Data:

    China Customs Code:

    2916209090

    Overview:

    2916209090 other(Cycloalkane\Cycloene\Cyclic terpene)Monocarboxylic acid(Including anhydrides\Acyl halide,Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0% Tax refund rate:9.0% Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods) 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

    Regulatory conditions:

    A.Customs clearance form for Inbound Goods
    B.Customs clearance form for outbound goods

    Inspection and quarantine category:

    R.Sanitary supervision and inspection of imported food
    S.Sanitary supervision and inspection of exported food
    M.Import commodity inspection
    N.Export commodity inspection

    Summary:

    2916209090 other cyclanic, cyclenic or cyclotherpenic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:6.5% General tariff:30.0%

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate Pricemore >>

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Additional information on 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate

Comprehensive Overview of 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate (CAS No. 380336-99-2)

4-Formyl-2-methoxyphenyl cyclopropanecarboxylate (CAS No. 380336-99-2) is a specialized organic compound that has garnered significant attention in the fields of pharmaceutical research, agrochemical development, and material science. This compound, characterized by its unique cyclopropane and formyl-methoxyphenyl functional groups, serves as a versatile intermediate in synthetic chemistry. Its molecular structure, combining a formyl group and a methoxy substituent on an aromatic ring, makes it a valuable building block for designing complex molecules.

In recent years, the demand for 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate has surged due to its potential applications in drug discovery. Researchers are particularly interested in its role as a precursor for bioactive molecules, including anti-inflammatory and antimicrobial agents. The cyclopropane ring in its structure is known to enhance metabolic stability, a feature highly sought after in the development of new therapeutics. This aligns with the growing trend of structure-activity relationship (SAR) studies, where subtle modifications to molecular frameworks can lead to significant improvements in drug efficacy.

From an agrochemical perspective, 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate is explored for its potential in creating novel pesticides and herbicides. The methoxyphenyl moiety is often associated with herbicidal activity, while the formyl group can be further functionalized to tailor the compound's properties. This adaptability makes it a promising candidate for addressing challenges in sustainable agriculture, a topic of increasing importance given the global focus on food security and environmental sustainability.

The synthesis of 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate typically involves multi-step organic reactions, including esterification and formylation processes. Advanced techniques such as microwave-assisted synthesis and catalytic hydrogenation have been employed to improve yield and efficiency. These methods resonate with the current emphasis on green chemistry, as researchers strive to minimize waste and energy consumption in chemical production.

In material science, this compound's aromatic-aliphatic hybrid structure offers intriguing possibilities for designing functional polymers and liquid crystals. Its ability to participate in cross-coupling reactions and cycloadditions makes it a valuable component in creating advanced materials with tailored optical or electronic properties. This aligns with the rising interest in smart materials and nanotechnology, where precise molecular control is essential for achieving desired performance characteristics.

Analytical characterization of 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate typically involves techniques such as nuclear magnetic resonance (NMR) spectroscopy, mass spectrometry (MS), and high-performance liquid chromatography (HPLC). These methods ensure purity and confirm structural integrity, which are critical for research and industrial applications. The compound's stability under various conditions is also a subject of ongoing study, particularly for applications requiring long-term storage or exposure to different environments.

As the scientific community continues to explore the potential of 4-Formyl-2-methoxyphenyl cyclopropanecarboxylate, its relevance in addressing contemporary challenges becomes increasingly apparent. Whether in the development of new pharmaceuticals, eco-friendly agrochemicals, or innovative materials, this compound exemplifies how molecular design can contribute to technological advancement. Its versatility and adaptability make it a compelling subject for further research and application across multiple disciplines.

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