Cas no 24321-79-7 ((2-Isothiocyanatoethyl)cyclopentane)

(2-Isothiocyanatoethyl)cyclopentane is a cyclopentane derivative functionalized with an isothiocyanate group, offering versatile reactivity in organic synthesis and bioconjugation applications. The isothiocyanate moiety enables selective coupling with amines, making it valuable for the preparation of thiourea derivatives or as a linker in peptide and protein modification. Its cyclopentane backbone contributes to structural stability while maintaining moderate lipophilicity, which can influence solubility and binding interactions in designed compounds. This compound is particularly useful in medicinal chemistry and materials science, where controlled functionalization is required. Proper handling under inert conditions is recommended due to the reactivity of the isothiocyanate group.
(2-Isothiocyanatoethyl)cyclopentane structure
24321-79-7 structure
Product Name:(2-Isothiocyanatoethyl)cyclopentane
CAS No:24321-79-7
MF:C8H13NS
MW:155.26052069664
MDL:MFCD09055322
CID:913020
PubChem ID:28063947
Update Time:2025-06-08

(2-Isothiocyanatoethyl)cyclopentane Chemical and Physical Properties

Names and Identifiers

    • (2-Isothiocyanatoethyl)cyclopentane
    • (2-isothiocyanatoethyl)cyclopentane(SALTDATA: FREE)
    • 2-isothiocyanatoethylcyclopentane
    • isothiocyanic acid, 2-cyclopentylethyl ester (8ci)
    • ISOTHIOCYANIC ACID 2-CYCLOPENTYLETHYL ESTER
    • DB-179112
    • MFCD09055322
    • (2-Isothiocyanatoethyl)cyclopentane, AldrichCPR
    • DTXSID30650875
    • AKOS010143199
    • 24321-79-7
    • MDL: MFCD09055322
    • Inchi: 1S/C8H13NS/c10-7-9-6-5-8-3-1-2-4-8/h8H,1-6H2
    • InChI Key: YHIOIHCWPRVEPE-UHFFFAOYSA-N
    • SMILES: S=C=NCCC1CCCC1

Computed Properties

  • Exact Mass: 155.07700
  • Monoisotopic Mass: 155.07687059g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 3
  • Complexity: 132
  • 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: 4.2
  • Topological Polar Surface Area: 44.4?2

Experimental Properties

  • PSA: 44.45000
  • LogP: 2.66950

(2-Isothiocyanatoethyl)cyclopentane Customs Data

  • HS CODE:2930909090
  • Customs Data:

    China Customs Code:

    2930909090

    Overview:

    2930909090. Other organic sulfur compounds. 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:

    2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

(2-Isothiocyanatoethyl)cyclopentane Pricemore >>

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Additional information on (2-Isothiocyanatoethyl)cyclopentane

Comprehensive Analysis of (2-Isothiocyanatoethyl)cyclopentane (CAS No. 24321-79-7): Properties, Applications, and Industry Trends

The chemical compound (2-Isothiocyanatoethyl)cyclopentane (CAS No. 24321-79-7) is a specialized organic molecule gaining attention in pharmaceutical and agrochemical research. Characterized by its unique cyclopentane backbone and reactive isothiocyanate functional group, this compound serves as a versatile building block in synthetic chemistry. Its molecular structure, C8H13NS, combines aliphatic and heteroatomic features, enabling diverse reactivity patterns.

Recent advancements in small-molecule drug discovery have increased demand for functionalized cyclopentane derivatives. The 2-isothiocyanatoethyl moiety in particular shows promise for creating bioconjugation probes and covalent inhibitors, with researchers exploring its potential in targeted protein modification. Analytical techniques like HPLC-MS and NMR spectroscopy confirm the compound's high purity (>98%) and stability under controlled conditions.

From an industrial perspective, 24321-79-7 demonstrates excellent solubility in common organic solvents including dichloromethane and tetrahydrofuran, making it suitable for various reaction systems. The compound's thermal stability (decomposition point >150°C) allows for applications in high-temperature processes. Manufacturers emphasize strict quality control protocols to ensure batch-to-batch consistency for research applications.

Emerging studies highlight the compound's utility in click chemistry applications, particularly when paired with amine-containing biomolecules. This aligns with current trends in proteomics research and biomarker discovery, where researchers frequently search for "effective protein labeling reagents" or "small molecule crosslinkers." The cyclopentane ring contributes to enhanced membrane permeability compared to linear analogs.

Environmental considerations for (2-Isothiocyanatoethyl)cyclopentane include proper waste disposal procedures and green chemistry alternatives. The scientific community shows growing interest in developing water-soluble variants to reduce organic solvent use. These developments respond to frequent queries about "eco-friendly chemical modifications" and "sustainable research reagents."

Storage recommendations for CAS No. 24321-79-7 typically suggest argon atmosphere protection at -20°C to maintain optimal stability. Suppliers provide detailed material safety data information addressing common concerns about chemical handling and storage conditions. The compound's shelf life exceeds 24 months when properly stored, making it practical for long-term research projects.

Future research directions may explore the compound's potential in polymer chemistry and material science applications. The unique combination of rigid cyclopentane structure and reactive isothiocyanate group offers possibilities for creating novel crosslinked materials. These applications align with trending searches for "advanced functional materials" and "smart polymer precursors."

Analytical challenges associated with 24321-79-7 include developing robust quantification methods for trace analysis. Recent publications describe optimized GC-MS protocols for detecting the compound at ppm levels. Such methodological advancements address researchers' frequent questions about "sensitive detection techniques" for specialized organic compounds.

The global market for cyclopentane derivatives shows steady growth, with (2-Isothiocyanatoethyl)cyclopentane occupying a niche segment. Industry reports indicate increasing demand from contract research organizations and academic laboratories. Pricing trends reflect the compound's specialized nature and the technical expertise required for its synthesis.

Comparative studies with similar compounds reveal that 24321-79-7 offers distinct advantages in certain stereoselective reactions. The constrained cyclopentane conformation influences reaction outcomes differently than cyclohexane analogs, a topic frequently explored in "structure-activity relationship" studies. These characteristics make the compound valuable for asymmetric synthesis applications.

Quality assessment protocols for (2-Isothiocyanatoethyl)cyclopentane typically include chiral purity verification when applicable. Advanced separation techniques like chiral HPLC help ensure the compound meets research-grade specifications. Such rigorous testing responds to the scientific community's emphasis on reproducible research materials.

In conclusion, CAS No. 24321-79-7 represents an important tool for modern chemical research with expanding applications across multiple disciplines. Its balanced properties of reactivity and stability, combined with the growing understanding of its behavior in various systems, position this compound as a valuable asset in both academic and industrial settings. Continued research will likely uncover additional utilities for this versatile molecule.

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