Cas no 680619-21-0 (Spiro[2.6]nonane-1-carboxylic acid)

Spiro[2.6]nonane-1-carboxylic acid is a rigid, spirocyclic carboxylic acid characterized by its unique bicyclic structure, which imparts steric constraints and conformational stability. This compound is of interest in synthetic and medicinal chemistry due to its potential as a building block for designing structurally constrained analogs or bioactive molecules. The spirocyclic framework enhances metabolic stability and may influence binding affinity in target interactions. Its carboxylic acid functionality allows for further derivatization, enabling incorporation into peptides, small molecules, or metal-organic frameworks. The compound’s defined stereochemistry and compact ring system make it valuable for studying structure-activity relationships in drug discovery and materials science applications.
Spiro[2.6]nonane-1-carboxylic acid structure
680619-21-0 structure
Product Name:Spiro[2.6]nonane-1-carboxylic acid
CAS No:680619-21-0
MF:C10H16O2
MW:168.232843399048
CID:4140459
PubChem ID:10241191
Update Time:2025-06-13

Spiro[2.6]nonane-1-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • Spiro[2.6]nonane-1-carboxylic acid
    • SCHEMBL1635774
    • AT31905
    • AKOS011675724
    • FOBZAFPBSOXPSX-UHFFFAOYSA-N
    • 680619-21-0
    • EN300-1253902
    • Inchi: 1S/C10H16O2/c11-9(12)8-7-10(8)5-3-1-2-4-6-10/h8H,1-7H2,(H,11,12)
    • InChI Key: FOBZAFPBSOXPSX-UHFFFAOYSA-N
    • SMILES: C1(C(O)=O)C2(CCCCCC2)C1

Computed Properties

  • Exact Mass: 168.115029749Da
  • Monoisotopic Mass: 168.115029749Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 190
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 37.3?2

Spiro[2.6]nonane-1-carboxylic acid Pricemore >>

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Additional information on Spiro[2.6]nonane-1-carboxylic acid

Exploring the Unique Properties and Applications of Spiro[2.6]nonane-1-carboxylic acid (CAS No. 680619-21-0)

In the realm of organic chemistry, Spiro[2.6]nonane-1-carboxylic acid (CAS No. 680619-21-0) stands out as a fascinating compound with a distinctive spirocyclic structure. This carboxylic acid derivative has garnered significant attention due to its unique molecular architecture, which combines a spiro[2.6]nonane framework with a carboxylic acid functional group. Researchers and industry professionals are increasingly exploring its potential in various fields, from pharmaceutical intermediates to material science.

The spirocyclic structure of Spiro[2.6]nonane-1-carboxylic acid is particularly noteworthy. Spiro compounds, characterized by two rings sharing a single carbon atom, often exhibit enhanced stability and unique stereochemical properties. This makes them valuable in drug discovery, where rigid frameworks can improve binding affinity and selectivity. The carboxylic acid group further enhances its utility, enabling easy derivatization for applications such as peptide synthesis or polymer modification.

Recent trends in green chemistry have also highlighted the importance of compounds like Spiro[2.6]nonane-1-carboxylic acid. With growing demand for sustainable chemical processes, researchers are investigating its role in biodegradable materials and eco-friendly catalysts. Its potential as a building block for bio-based polymers aligns with global efforts to reduce reliance on fossil fuels, a topic frequently searched in AI-driven research tools and scientific databases.

Another area of interest is the compound’s applicability in asymmetric synthesis. The rigid spirocyclic core can serve as a chiral scaffold, a feature highly sought after in the production of enantiomerically pure compounds. This aligns with current industry demands for high-precision chemical synthesis, a recurring theme in patent literature and academic publications.

From a spectroscopic perspective, Spiro[2.6]nonane-1-carboxylic acid presents intriguing characteristics. Nuclear magnetic resonance (NMR) studies reveal distinct proton environments due to its constrained geometry, while infrared (IR) spectroscopy confirms the presence of the carboxyl group. These properties make it a useful reference compound for analytical method development, a topic often queried in chemical forums and educational platforms.

In the context of computational chemistry, the compound’s structure has been modeled to predict its conformational behavior and electronic properties. Such studies are crucial for molecular docking simulations, particularly in structure-activity relationship (SAR) analyses. This intersection of experimental and theoretical chemistry reflects broader trends in data-driven research, a hot topic in scientific SEO queries.

Looking ahead, the versatility of Spiro[2.6]nonane-1-carboxylic acid (CAS No. 680619-21-0) ensures its continued relevance. Whether as a specialty chemical for niche applications or a platform molecule for innovation, its unique attributes will likely inspire further exploration. For researchers navigating chemical databases or AI-powered literature reviews, this compound remains a compelling subject of study.

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