Cas no 38559-92-1 (4-(Benzyloxy)phenoxyacetic acid)

4-(Benzyloxy)phenoxyacetic acid is a synthetic organic compound featuring a benzyl-protected phenoxyacetic acid structure. Its key functional groups—a benzyl ether and a carboxylic acid—make it a versatile intermediate in organic synthesis, particularly for the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The benzyloxy group offers selective deprotection potential, enabling controlled modifications in multi-step syntheses. The carboxylic acid moiety allows for further derivatization, such as esterification or amidation. This compound is valued for its stability under standard conditions and its compatibility with a range of reaction conditions, making it a reliable building block in medicinal chemistry and material science applications.
4-(Benzyloxy)phenoxyacetic acid structure
38559-92-1 structure
Product Name:4-(Benzyloxy)phenoxyacetic acid
CAS No:38559-92-1
MF:C15H14O4
MW:258.269264698029
MDL:MFCD00014361
CID:89309
PubChem ID:563696
Update Time:2025-05-21

4-(Benzyloxy)phenoxyacetic acid Chemical and Physical Properties

Names and Identifiers

    • 4-Benzyloxyphenoxyacetic acid
    • [4-(Benzyloxy)phenoxy]acetic acid
    • 2-(4-phenylmethoxyphenoxy)acetic acid
    • 4-(Benzyloxy)phenoxyacetic acid
    • Aceticacid, [4-(phenylmethoxy)phenoxy]- (9CI)
    • Acetic acid, [p-(benzyloxy)phenoxy]-(6CI,7CI)
    • 2-[4-(Benzyloxy)phenoxy]acetic acid
    • FT-0616696
    • (4-benzyloxy-phenoxy)-acetic acid
    • 2-[4-(Phenylmethoxy)phenoxy]-acetic acid
    • AKOS000113091
    • Oprea1_606095
    • (4-(Phenylmethoxy)phenoxy)acetic acid
    • DTXSID40191885
    • [4-(phenylmethoxy)phenoxy]acetic acid
    • 2-(4-(benzyloxy)phenoxy)aceticacid
    • NS00030415
    • 4-THIOMORPHOLINEACETICACID,ETHYLESTER
    • SR-01000031965
    • AS-62464
    • 2-(4-(benzyloxy)phenoxy)acetic acid
    • HMS1400B13
    • SCHEMBL1115002
    • (4-benzyloxyphenoxy)acetic acid
    • EINECS 254-000-2
    • Z56827842
    • WAY-110969
    • EN300-16921
    • MFCD00014361
    • A50574
    • SR-01000031965-1
    • 38559-92-1
    • Acetic acid, [4-(phenylmethoxy)phenoxy]-
    • Enamine_002147
    • STK098821
    • DB-049303
    • BBL000004
    • 2-(4-Benzyloxyphenoxy)acetic acid
    • ALBB-024386
    • MDL: MFCD00014361
    • Inchi: 1S/C15H14O4/c16-15(17)11-19-14-8-6-13(7-9-14)18-10-12-4-2-1-3-5-12/h1-9H,10-11H2,(H,16,17)
    • InChI Key: VXMSXBVTUNOSLL-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CC=1)OCC(=O)O)CC1C=CC=CC=1
    • BRN: 2469260

Computed Properties

  • Exact Mass: 258.08900
  • Monoisotopic Mass: 258.089
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 6
  • Complexity: 265
  • 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: nothing
  • Topological Polar Surface Area: 55.8A^2

Experimental Properties

  • Color/Form: solid
  • Density: 1.2±0.1 g/cm3
  • Melting Point: 139-140°C
  • Boiling Point: 436.9±25.0 °C at 760 mmHg
  • Flash Point: 164.9±16.7 °C
  • Refractive Index: 1.586
  • PSA: 55.76000
  • LogP: 2.72900
  • Solubility: Not determined
  • Vapor Pressure: 0.0±1.1 mmHg at 25°C

4-(Benzyloxy)phenoxyacetic acid Security Information

4-(Benzyloxy)phenoxyacetic acid Customs Data

  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). 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

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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Additional information on 4-(Benzyloxy)phenoxyacetic acid

4-(Benzyloxy)phenoxyacetic Acid: A Comprehensive Overview

4-(Benzyloxy)phenoxyacetic acid (CAS No: 38559-92-1) is a compound of significant interest in the fields of organic chemistry and pharmacology. This compound, with its unique structure and properties, has been the subject of extensive research, particularly in recent years, due to its potential applications in drug development and material science.

The molecular structure of 4-(Benzyloxy)phenoxyacetic acid is characterized by a phenoxy group attached to an acetic acid moiety, with a benzyloxy substituent at the para position of the phenyl ring. This arrangement imparts specific electronic and steric properties to the molecule, making it a versatile building block in organic synthesis. The compound's ability to undergo various functional group transformations has made it a valuable intermediate in the synthesis of more complex molecules.

Recent studies have highlighted the potential of 4-(Benzyloxy)phenoxyacetic acid as a precursor in the development of bioactive compounds. For instance, researchers have explored its role in the synthesis of analogs with anti-inflammatory and antioxidant properties. These findings underscore the importance of understanding the compound's reactivity and stability under different reaction conditions.

In terms of synthesis, 4-(Benzyloxy)phenoxyacetic acid can be prepared through several routes, including nucleophilic aromatic substitution and coupling reactions. The choice of synthetic pathway often depends on the desired scale and purity of the product. Recent advancements in catalytic methods have further enhanced the efficiency and selectivity of these reactions, paving the way for large-scale production.

The application of 4-(Benzyloxy)phenoxyacetic acid extends beyond traditional chemical synthesis. Its derivatives have shown promise in pharmaceutical research, particularly in the design of drugs targeting specific biological pathways. For example, certain derivatives have demonstrated activity against enzymes involved in inflammation and oxidative stress, making them potential candidates for therapeutic intervention.

Moreover, 4-(Benzyloxy)phenoxyacetic acid has been investigated for its role in polymer chemistry. The compound's ability to form stable bonds under certain conditions has led to its use in the development of novel polymeric materials with tailored properties. These materials hold potential applications in areas such as drug delivery systems and biodegradable plastics.

Recent research has also focused on the environmental impact of 4-(Benzyloxy)phenoxyacetic acid and its derivatives. Studies have assessed their biodegradability and toxicity profiles, providing valuable insights into their safe handling and disposal. These findings are crucial for ensuring that the compound's use aligns with sustainable chemical practices.

In conclusion, 4-(Benzyloxy)phenoxyacetic acid (CAS No: 38559-92-1) is a multifaceted compound with a wide range of applications across various scientific disciplines. Its structural versatility, coupled with recent advancements in synthetic methods and biological applications, positions it as a key player in future research and development efforts.

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