Cas no 147598-21-8 (3-4-(2-methylpropyl)phenylpropan-1-ol)

3-4-(2-Methylpropyl)phenylpropan-1-ol is a synthetic organic compound featuring a phenylpropanol backbone with a 2-methylpropyl substituent at the para position of the phenyl ring. This structure imparts unique physicochemical properties, making it valuable as an intermediate in fine chemical synthesis, particularly in pharmaceuticals and fragrances. The presence of the hydroxyl group enhances its reactivity for further functionalization, while the branched alkyl chain contributes to lipophilicity, influencing solubility and bioavailability. Its well-defined molecular architecture ensures consistency in downstream applications. The compound is typically characterized by high purity (>98%) and stability under standard storage conditions, meeting rigorous industry standards for research and industrial use.
3-4-(2-methylpropyl)phenylpropan-1-ol structure
147598-21-8 structure
Product Name:3-4-(2-methylpropyl)phenylpropan-1-ol
CAS No:147598-21-8
MF:C13H20O
MW:192.297304153442
CID:100732
PubChem ID:23168111
Update Time:2025-11-02

3-4-(2-methylpropyl)phenylpropan-1-ol Chemical and Physical Properties

Names and Identifiers

    • Benzenepropanol,4-(2-methylpropyl)-
    • 3-[4-(2-methylpropyl)phenyl]propan-1-ol
    • 4-(2-methylpropyl)Benzenepropanol
    • 3-(4-ISOBUTYL-PHENYL)-PROPAN-1-OL
    • FT-0734262
    • 3-(4-isobutylphenyl)propan-1-ol
    • 147598-21-8
    • JFAIHGYUKITHLQ-UHFFFAOYSA-N
    • EN300-115576
    • AKOS006288350
    • SCHEMBL9340223
    • SB85280
    • DTXSID40631170
    • Benzenepropanol, 4-(2-methylpropyl)-
    • Z1198182739
    • 3-4-(2-methylpropyl)phenylpropan-1-ol
    • Inchi: 1S/C13H20O/c1-11(2)10-13-7-5-12(6-8-13)4-3-9-14/h5-8,11,14H,3-4,9-10H2,1-2H3
    • InChI Key: JFAIHGYUKITHLQ-UHFFFAOYSA-N
    • SMILES: OCCCC1C=CC(=CC=1)CC(C)C

Computed Properties

  • Exact Mass: 192.15100
  • Monoisotopic Mass: 192.151415257g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 5
  • Complexity: 134
  • 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: 3.4
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • PSA: 20.23000
  • LogP: 2.81000

3-4-(2-methylpropyl)phenylpropan-1-ol Pricemore >>

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Additional information on 3-4-(2-methylpropyl)phenylpropan-1-ol

Comprehensive Guide to 3-4-(2-methylpropyl)phenylpropan-1-ol (CAS No. 147598-21-8): Properties, Applications, and Market Insights

3-4-(2-methylpropyl)phenylpropan-1-ol (CAS No. 147598-21-8) is a specialized organic compound that has garnered significant attention in the chemical and pharmaceutical industries. This aromatic alcohol, characterized by its unique molecular structure, serves as a key intermediate in the synthesis of various high-value products. With the growing demand for fine chemicals and pharmaceutical intermediates, understanding the properties and applications of this compound is essential for researchers and industry professionals.

The chemical structure of 3-4-(2-methylpropyl)phenylpropan-1-ol features a phenyl ring substituted with a 2-methylpropyl group and a propan-1-ol side chain. This configuration imparts specific physicochemical properties, making it suitable for diverse applications. The compound is often utilized in the development of fragrances, flavoring agents, and cosmetic ingredients, where its stability and solubility play a critical role. Recent studies have also explored its potential in green chemistry and sustainable synthesis, aligning with the global shift toward environmentally friendly processes.

One of the most searched questions related to 3-4-(2-methylpropyl)phenylpropan-1-ol is its role in drug discovery. Researchers are increasingly interested in its use as a building block for bioactive molecules, particularly in the design of central nervous system (CNS) therapeutics. Its structural flexibility allows for modifications that can enhance drug bioavailability and target specificity. Additionally, the compound's compatibility with catalytic hydrogenation and other modern synthetic techniques makes it a valuable asset in medicinal chemistry.

From an industrial perspective, the market for 3-4-(2-methylpropyl)phenylpropan-1-ol is expanding, driven by the rising demand for high-purity intermediates in the pharmaceutical and cosmetic sectors. Manufacturers are focusing on optimizing production processes to meet stringent quality standards, ensuring compliance with Good Manufacturing Practices (GMP). The compound's stability under various storage conditions further enhances its appeal for large-scale applications.

In the context of SEO optimization, keywords such as "buy 3-4-(2-methylpropyl)phenylpropan-1-ol," "CAS 147598-21-8 supplier," and "applications of aromatic alcohols" are frequently searched by potential buyers and researchers. Highlighting these terms ensures better visibility in search engine results. Furthermore, integrating trending topics like sustainable chemistry and AI-driven drug design can attract a broader audience interested in cutting-edge scientific advancements.

Safety and handling of 3-4-(2-methylpropyl)phenylpropan-1-ol are also critical considerations. While the compound is not classified as hazardous under standard regulations, proper storage in cool, dry environments is recommended to maintain its integrity. Material Safety Data Sheets (MSDS) provide detailed guidelines for safe usage, emphasizing the importance of personal protective equipment (PPE) in laboratory settings.

Looking ahead, the versatility of 3-4-(2-methylpropyl)phenylpropan-1-ol positions it as a compound of continued interest. Innovations in catalysis and process optimization are expected to further enhance its accessibility and application scope. For businesses and researchers, staying updated on the latest developments in this field can unlock new opportunities in specialty chemicals and life sciences.

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