Cas no 729-17-9 (Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate)

Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate is a biphenyl derivative featuring a methoxy group at the 4' position and a methyl ester at the 4 position. This compound serves as a versatile intermediate in organic synthesis, particularly in the preparation of liquid crystals, pharmaceuticals, and advanced materials. Its rigid biphenyl core and functional groups enable precise modifications for tailored applications. The methoxy and ester substituents enhance solubility and reactivity, facilitating further derivatization. High purity grades are available for research and industrial use, ensuring consistency in synthetic processes. Its stability and well-defined structure make it a reliable building block for complex molecular architectures.
Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate structure
729-17-9 structure
Product Name:Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate
CAS No:729-17-9
MF:C15H14O3
MW:242.269864559174
MDL:MFCD01122234
CID:39732
PubChem ID:1393415
Update Time:2025-11-01

Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4'-methoxy[1,1'-biphenyl]-4-carboxylate
    • Methyl 4'-methoxybiphenyl-4-carboxylate
    • [1,1'-BIPHENYL]-4-CARBOXYLIC ACID 4'-METHOXY-,METHYL ESTER
    • methyl 4-(4-methoxyphenyl)benzoate
    • 4'-Methoxybiphenyl-4-carboxylic acid methyl ester
    • 4-methyloxycarbonyl-4'-methoxy-1,1'-biphenyl
    • AMTDA028
    • methyl 1-(4'-methoxy-biphenyl-4-yl)-carboxylate
    • methyl 4-(4'-methoxyphenyl)benzoate
    • methyl 4'-methoxy(1,1'-biphenyl)-4-carboxylate
    • BB 0222617
    • A918271
    • METHYL 4'-METHOXY-[1,1'-BIPHENYL]-4-CARBOXYLATE
    • E89543
    • MFCD01122234
    • METHYL4'-METHOXYBIPHENYL-4-CARBOXYLATE
    • 4'-methoxy-biphenyl-4-carboxylic acid methyl ester
    • DTXSID10362686
    • AKOS002679517
    • SCHEMBL269558
    • BS-42333
    • YJOVQAHQGZBWIU-UHFFFAOYSA-N
    • 729-17-9
    • CS-0189010
    • Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate
    • MDL: MFCD01122234
    • Inchi: 1S/C15H14O3/c1-17-14-9-7-12(8-10-14)11-3-5-13(6-4-11)15(16)18-2/h3-10H,1-2H3
    • InChI Key: YJOVQAHQGZBWIU-UHFFFAOYSA-N
    • SMILES: O(C)C1C=CC(=CC=1)C1C=CC(C(=O)OC)=CC=1

Computed Properties

  • Exact Mass: 242.09400
  • Monoisotopic Mass: 242.094
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 4
  • Complexity: 261
  • 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: 3.9
  • Topological Polar Surface Area: 35.5A^2

Experimental Properties

  • Density: 1.118
  • Boiling Point: 373.6°C at 760 mmHg
  • Flash Point: 156.6°C
  • Refractive Index: 1.552
  • PSA: 35.53000
  • LogP: 3.14880

Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate Security Information

Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate Customs Data

  • HS CODE:2922299090
  • Customs Data:

    China Customs Code:

    2922299090

    Overview:

    2922299090. Other amino groups(naphthol\phenol)And ether\Esters [including their salts, Except those containing more than one oxygen-containing group]. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared

    Summary:

    2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate Pricemore >>

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Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate Related Literature

Additional information on Methyl 4'-Methoxy1,1'-biphenyl-4-carboxylate

Recent Advances in the Study of Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate (CAS: 729-17-9) in Chemical Biology and Pharmaceutical Research

Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate (CAS: 729-17-9) is a biphenyl derivative that has garnered significant attention in chemical biology and pharmaceutical research due to its versatile applications in drug discovery and material science. Recent studies have explored its potential as a key intermediate in the synthesis of bioactive compounds, particularly in the development of anti-inflammatory and anticancer agents. This research brief aims to summarize the latest findings related to this compound, highlighting its synthesis, biological activity, and potential therapeutic applications.

One of the most notable advancements in the study of Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate is its role in the synthesis of novel small-molecule inhibitors targeting specific signaling pathways. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that derivatives of this compound exhibit potent inhibitory effects on NF-κB, a transcription factor implicated in chronic inflammation and cancer progression. The study utilized a combination of molecular docking and in vitro assays to identify the most promising candidates, with Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate serving as a critical scaffold for further optimization.

In addition to its pharmacological potential, recent research has also focused on the synthetic methodologies for producing Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate with high yield and purity. A 2022 paper in Organic & Biomolecular Chemistry reported an efficient Pd-catalyzed Suzuki-Miyaura cross-coupling reaction for the synthesis of this compound, achieving a yield of over 85%. This methodological improvement is expected to facilitate large-scale production and further exploration of its applications in drug development.

Beyond its use in drug discovery, Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate has also been investigated for its potential in material science. A recent study in ACS Applied Materials & Interfaces highlighted its utility as a building block for organic semiconductors, owing to its favorable electronic properties and structural stability. This dual applicability in both pharmaceuticals and materials underscores the compound's versatility and broad relevance in scientific research.

In conclusion, Methyl 4'-Methoxy-1,1'-biphenyl-4-carboxylate (CAS: 729-17-9) continues to be a compound of significant interest in chemical biology and pharmaceutical research. Its role as a scaffold for bioactive molecules, coupled with advancements in synthetic methodologies, positions it as a valuable tool for future drug discovery and material science endeavors. Ongoing research is expected to further elucidate its mechanisms of action and expand its applications in these fields.

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