Cas no 926925-73-7 (2-Pentyl-1H-indene)

2-Pentyl-1H-indene is a substituted indene derivative characterized by a five-carbon alkyl chain at the 2-position of the indene ring system. This compound is of interest in organic synthesis and materials science due to its structural versatility, serving as a precursor for functionalized polycyclic aromatic hydrocarbons (PAHs) and specialty polymers. Its pentyl side chain enhances solubility in nonpolar solvents, facilitating processing in synthetic applications. The indene core provides reactivity for further functionalization, including Diels-Alder reactions or electrophilic substitutions. Potential applications include the development of liquid crystals, organic semiconductors, or intermediates for pharmacologically active compounds. The compound's stability and well-defined structure make it suitable for controlled synthetic modifications.
2-Pentyl-1H-indene structure
2-Pentyl-1H-indene structure
Product Name:2-Pentyl-1H-indene
CAS No:926925-73-7
MF:C14H18
MW:186.292724132538
CID:890528
PubChem ID:18402023
Update Time:2025-06-15

2-Pentyl-1H-indene Chemical and Physical Properties

Names and Identifiers

    • 2-Pentyl-1H-indene
    • DTXSID10593413
    • AKOS006286741
    • 926925-73-7
    • DB-365225
    • MDL: MFCD06797412
    • Inchi: 1S/C14H18/c1-2-3-4-7-12-10-13-8-5-6-9-14(13)11-12/h5-6,8-10H,2-4,7,11H2,1H3
    • InChI Key: MGACGOOGXAEMIQ-UHFFFAOYSA-N
    • SMILES: C1(=CC2C=CC=CC=2C1)CCCCC

Computed Properties

  • Exact Mass: 186.140850574g/mol
  • Monoisotopic Mass: 186.140850574g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 202
  • 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: 4.7
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • LogP: 4.20640

2-Pentyl-1H-indene Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
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926925-73-7 95%
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$400.00 2023-08-31
Chemenu
CM194862-5g
2-Pentyl-1H-indene
926925-73-7 95%
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Additional information on 2-Pentyl-1H-indene

Introduction to 2-Pentyl-1H-indene (CAS No: 926925-73-7)

2-Pentyl-1H-indene, identified by the Chemical Abstracts Service Number (CAS No) 926925-73-7, is a significant organic compound that has garnered attention in the field of pharmaceutical and materials chemistry. This molecule, characterized by its indene core substituted with a pentyl group, exhibits unique structural and electronic properties that make it a valuable candidate for various applications, particularly in the development of advanced materials and bioactive molecules.

The structural framework of 2-Pentyl-1H-indene consists of a benzene ring fused to a cyclopentene ring, with the pentyl group attached at the 2-position of the indene structure. This substitution pattern imparts distinct reactivity and functionality, making it a versatile intermediate in synthetic chemistry. The presence of the pentyl group enhances the lipophilicity of the molecule, which is a critical factor in drug design and formulation.

In recent years, 2-Pentyl-1H-indene has been explored for its potential applications in pharmaceutical research. Its indene moiety is known to exhibit aromatic stability and can serve as a scaffold for designing novel bioactive compounds. Researchers have been particularly interested in its ability to interact with biological targets due to its rigid planar structure, which can facilitate precise binding interactions. Preliminary studies suggest that derivatives of 2-Pentyl-1H-indene may exhibit pharmacological activity in areas such as anti-inflammatory and antimicrobial applications.

The synthesis of 2-Pentyl-1H-indene typically involves organic reactions that construct the indene core followed by functionalization with the pentyl group. Advanced synthetic methodologies, including cross-coupling reactions and metathesis processes, have been employed to achieve high yields and purity. These synthetic approaches are crucial for producing sufficient quantities of the compound for further research and development.

One of the most promising areas of research involving 2-Pentyl-1H-indene is in the development of organic electronic materials. The compound's conjugated system and electron-rich nature make it suitable for applications in organic light-emitting diodes (OLEDs), organic photovoltaics (OPVs), and other optoelectronic devices. Recent studies have demonstrated that incorporating 2-Pentyl-1H-indene into polymer blends can enhance charge transport properties, leading to improved device performance.

Additionally, the chemical reactivity of 2-Pentyl-1H-indene has been investigated for its potential use in catalytic processes. The compound's ability to undergo various transformations under controlled conditions makes it an attractive candidate for designing new catalysts or as a ligand in transition metal-catalyzed reactions. Such applications could streamline synthetic routes for complex molecules, reducing costs and improving efficiency in industrial settings.

The pharmaceutical industry has also shown interest in exploring 2-Pentyl-1H-indene as a building block for drug discovery programs. Its structural features allow for modifications that can fine-tune biological activity, making it a valuable tool in medicinal chemistry. Researchers are leveraging computational methods to predict how different substitutions on the indene ring could influence pharmacokinetic properties, aiming to identify lead compounds with optimized therapeutic profiles.

In conclusion, 2-Pentyl-1H-indene (CAS No: 926925-73-7) represents a fascinating compound with diverse potential applications. Its unique structural characteristics and reactivity make it indispensable in both academic research and industrial development. As our understanding of its properties continues to grow, so too will its role in advancing technologies ranging from electronics to pharmaceuticals.

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