Cas no 103184-98-1 (1-Hexanol, 2,5-dimethyl-, (S)-)

(S)-2,5-Dimethyl-1-hexanol is a chiral secondary alcohol with the molecular formula C?H??O. This compound features a stereocenter at the hydroxyl-bearing carbon, making it useful in asymmetric synthesis and enantioselective reactions. Its branched alkyl chain contributes to moderate lipophilicity, enhancing solubility in organic solvents while maintaining stability under standard conditions. The (S)-enantiomer is particularly valuable in the production of fine chemicals, fragrances, and pharmaceuticals, where stereochemical purity is critical. Its defined configuration allows for precise control in chiral auxiliary applications or as a building block for complex molecules. The compound is typically characterized by GC-MS, NMR, and chiral HPLC to verify purity and enantiomeric excess.
1-Hexanol, 2,5-dimethyl-, (S)- structure
103184-98-1 structure
Product Name:1-Hexanol, 2,5-dimethyl-, (S)-
CAS No:103184-98-1
MF:C8H18O
MW:130.227922916412
CID:3563927
PubChem ID:13525938
Update Time:2025-11-03

1-Hexanol, 2,5-dimethyl-, (S)- Chemical and Physical Properties

Names and Identifiers

    • 1-Hexanol, 2,5-dimethyl-, (S)-
    • (2S)-2,5-dimethylhexan-1-ol
    • EN300-6507359
    • 103184-98-1
    • OBOHUKJIPIBYTA-QMMMGPOBSA-N
    • SCHEMBL15765507
    • Inchi: 1S/C8H18O/c1-7(2)4-5-8(3)6-9/h7-9H,4-6H2,1-3H3/t8-/m0/s1
    • InChI Key: OBOHUKJIPIBYTA-QMMMGPOBSA-N
    • SMILES: OC[C@@H](C)CCC(C)C

Computed Properties

  • Exact Mass: 130.135765193g/mol
  • Monoisotopic Mass: 130.135765193g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 4
  • Complexity: 59.6
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.6
  • Topological Polar Surface Area: 20.2?2

1-Hexanol, 2,5-dimethyl-, (S)- Pricemore >>

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1-Hexanol, 2,5-dimethyl-, (S)- Related Literature

Additional information on 1-Hexanol, 2,5-dimethyl-, (S)-

Recent Advances in the Study of 1-Hexanol, 2,5-dimethyl-, (S)- (CAS: 103184-98-1) in Chemical Biology and Pharmaceutical Research

The compound 1-Hexanol, 2,5-dimethyl-, (S)- (CAS: 103184-98-1) has recently garnered significant attention in the field of chemical biology and pharmaceutical research due to its unique structural properties and potential therapeutic applications. This chiral alcohol, characterized by its stereospecific configuration, has been the subject of several studies aimed at elucidating its biological activities, synthetic pathways, and potential as a lead compound in drug development. Recent literature highlights its role in modulating enzymatic activity, its use as a chiral building block in organic synthesis, and its emerging applications in medicinal chemistry.

One of the key findings in recent research is the compound's ability to interact with specific enzyme targets, particularly those involved in metabolic pathways. A 2023 study published in the Journal of Medicinal Chemistry demonstrated that (S)-2,5-dimethyl-1-hexanol exhibits inhibitory effects on certain cytochrome P450 enzymes, which are crucial for drug metabolism. This property suggests its potential utility in enhancing the bioavailability of co-administered drugs by modulating metabolic clearance. The study employed molecular docking simulations and in vitro assays to validate these interactions, providing a mechanistic understanding of its inhibitory effects.

In addition to its enzymatic modulation capabilities, (S)-2,5-dimethyl-1-hexanol has been explored for its role as a chiral auxiliary in asymmetric synthesis. A recent publication in Organic Letters (2024) detailed its use in the stereoselective synthesis of complex natural products, where it facilitated high enantiomeric excess in key synthetic steps. The study emphasized the compound's robustness under various reaction conditions, making it a versatile tool for synthetic chemists. Furthermore, its low toxicity profile, as confirmed by cytotoxicity assays, enhances its appeal for pharmaceutical applications.

Another area of interest is the compound's potential as a fragrance ingredient and its associated biological effects. Research conducted by the Flavor and Fragrance Journal (2023) investigated the olfactory properties of (S)-2,5-dimethyl-1-hexanol, revealing its unique sensory characteristics and stability in cosmetic formulations. The study also explored its antimicrobial properties, which could pave the way for dual-functional applications in personal care products. These findings underscore the multifaceted nature of this compound, bridging gaps between chemistry, biology, and consumer applications.

Looking ahead, the pharmaceutical industry is keenly interested in leveraging the chiral purity and bioactive properties of (S)-2,5-dimethyl-1-hexanol for drug development. Ongoing clinical trials are evaluating its efficacy as an adjunct therapy in metabolic disorders, with preliminary results indicating promising outcomes. Moreover, advances in synthetic biology are enabling the scalable production of this compound through engineered microbial pathways, as reported in a 2024 Nature Biotechnology article. This innovation addresses previous challenges related to its availability and cost, further solidifying its position in the pharmaceutical pipeline.

In conclusion, the latest research on 1-Hexanol, 2,5-dimethyl-, (S)- (CAS: 103184-98-1) highlights its diverse applications in chemical biology and pharmaceutical sciences. From enzymatic modulation to chiral synthesis and antimicrobial activity, this compound continues to demonstrate its versatility and potential. Future studies are expected to delve deeper into its mechanistic pathways and expand its therapeutic repertoire, making it a compound of enduring interest in the scientific community.

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