Cas no 28712-62-1 (3-methyl-5,6,7,8-tetrahydroquinoline)

3-Methyl-5,6,7,8-tetrahydroquinoline is a heterocyclic organic compound featuring a partially hydrogenated quinoline structure with a methyl substituent at the 3-position. This compound serves as a versatile intermediate in pharmaceutical and agrochemical synthesis due to its stable tetrahydroquinoline core, which enhances reactivity in functionalization reactions. Its saturated ring system improves solubility and bioavailability compared to fully aromatic analogs, making it valuable for drug development. The methyl group further allows for selective modifications, enabling tailored derivatization for target applications. With applications in catalysis and material science, this compound is recognized for its balanced reactivity and structural flexibility in complex synthetic pathways.
3-methyl-5,6,7,8-tetrahydroquinoline structure
28712-62-1 structure
Product Name:3-methyl-5,6,7,8-tetrahydroquinoline
CAS No:28712-62-1
MF:C10H13N
MW:147.216922521591
MDL:MFCD00006735
CID:284572
PubChem ID:120028
Update Time:2025-11-02

3-methyl-5,6,7,8-tetrahydroquinoline Chemical and Physical Properties

Names and Identifiers

    • Quinoline,5,6,7,8-tetrahydro-3-methyl-
    • 2-[2-(3,5-DIHYDROXY-PHENYL)-ETHYL]-6-HYDROXY-BENZOIC ACID ETHYL ESTER
    • 3-Methyl-5,6,7,8-tetrahydroquinoline
    • 5,6,7,8-Tetrahydro-3-methylquinoline
    • InChI=1/C10H13N/c1-8-6-9-4-2-3-5-10(9)11-7-8/h6-7H,2-5H2,1H
    • AKOS006282827
    • EINECS 249-183-0
    • 5,6,7,8-tetrahydro 3 methylquinoline
    • Quinoline, 5,6,7,8-tetrahydro-3-methyl-
    • DTXSID80182873
    • SCHEMBL2666127
    • 28712-62-1
    • 3-methyl-5, 6, 7, 8-tetrahydroquinoline
    • MFCD00006735
    • PYRIDINE,2,3-CYCLOHEXENE, 5-METHYL
    • 5.6,7,8-tetrahydro-3-methylquinoline
    • CS-0102418
    • EN300-249135
    • Q63393435
    • NS00028528
    • 3-Methyl-5,6,7,8-tetrahydrochinolin
    • 3-Methyl-5,6,7,8-tetrahydro-quinoline
    • G62952
    • DTXCID20105364
    • 3-methyl-5,6,7,8-tetrahydroquinoline
    • MDL: MFCD00006735
    • Inchi: 1S/C10H13N/c1-8-6-9-4-2-3-5-10(9)11-7-8/h6-7H,2-5H2,1H3
    • InChI Key: GMMKZUPOLVXWFF-UHFFFAOYSA-N
    • SMILES: N1C=C(C)C=C2C=1CCCC2

Computed Properties

  • Exact Mass: 147.10489
  • Monoisotopic Mass: 147.104799419g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 133
  • 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: 2.4
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89

3-methyl-5,6,7,8-tetrahydroquinoline Pricemore >>

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3-methyl-5,6,7,8-tetrahydroquinoline Related Literature

Additional information on 3-methyl-5,6,7,8-tetrahydroquinoline

Comprehensive Guide to 3-Methyl-5,6,7,8-tetrahydroquinoline (CAS No. 28712-62-1): Properties, Applications, and Market Insights

3-Methyl-5,6,7,8-tetrahydroquinoline (CAS No. 28712-62-1) is a versatile heterocyclic compound with a wide range of applications in pharmaceuticals, agrochemicals, and specialty chemicals. This tetrahydroquinoline derivative has gained significant attention due to its unique structural features, which make it a valuable intermediate in organic synthesis. In this comprehensive guide, we will explore the chemical properties, synthesis methods, applications, and market trends of this compound, while addressing common questions and search queries related to its use.

The molecular structure of 3-methyl-5,6,7,8-tetrahydroquinoline consists of a quinoline backbone with a methyl group at the 3-position and a saturated ring system. This configuration gives the compound distinct chemical properties that differ from its aromatic counterparts. With a molecular formula of C10H13N and a molecular weight of 147.22 g/mol, this compound exhibits moderate polarity and good solubility in common organic solvents, making it particularly useful in various chemical processes.

Recent searches in scientific databases and AI platforms reveal growing interest in "tetrahydroquinoline derivatives in drug discovery" and "sustainable synthesis of nitrogen heterocycles." These trends align perfectly with the applications of 3-methyl-5,6,7,8-tetrahydroquinoline, as researchers are increasingly exploring its potential in medicinal chemistry. The compound serves as a key building block for developing novel pharmaceutical agents, particularly in the areas of central nervous system (CNS) drugs and anti-inflammatory medications.

In the pharmaceutical industry, 3-methyl-5,6,7,8-tetrahydroquinoline has shown promise as a precursor for various bioactive molecules. Its structural similarity to naturally occurring alkaloids makes it particularly valuable for designing drug candidates with improved bioavailability and target specificity. Recent studies have investigated its derivatives for potential applications in treating neurodegenerative diseases, a hot topic in medical research that frequently appears in search queries like "heterocyclic compounds for Alzheimer's treatment."

The agrochemical sector also benefits from this compound, where it serves as an intermediate in the synthesis of crop protection agents. With increasing global focus on "sustainable agriculture" and "eco-friendly pesticides," the demand for specialized intermediates like 3-methyl-5,6,7,8-tetrahydroquinoline continues to grow. Its structural features allow for the development of novel pesticide formulations with improved environmental profiles and targeted activity.

From a synthetic chemistry perspective, researchers are particularly interested in "green chemistry approaches to tetrahydroquinolines." Modern synthetic methods for 3-methyl-5,6,7,8-tetrahydroquinoline emphasize atom economy, reduced waste generation, and energy efficiency. Catalytic hydrogenation of corresponding quinolines or innovative multicomponent reactions represent some of the sustainable approaches being developed, addressing the growing demand for environmentally friendly chemical processes.

The global market for tetrahydroquinoline derivatives has shown steady growth, driven by increasing applications in life sciences and specialty chemicals. Market analysis reveals particular interest in Asia-Pacific regions, where pharmaceutical and agrochemical manufacturing is expanding rapidly. Industry reports frequently highlight "growth trends in heterocyclic compound markets" as a key search term, reflecting the commercial importance of compounds like 3-methyl-5,6,7,8-tetrahydroquinoline.

Quality control and analytical characterization of 3-methyl-5,6,7,8-tetrahydroquinoline are critical aspects for industrial applications. Common analytical techniques include GC-MS, HPLC, and NMR spectroscopy, with purity specifications typically exceeding 98% for most applications. These quality parameters are particularly important for pharmaceutical uses, where stringent regulatory requirements must be met.

Storage and handling recommendations for 3-methyl-5,6,7,8-tetrahydroquinoline follow standard practices for nitrogen-containing heterocycles. The compound should be stored in tightly sealed containers under inert atmosphere, protected from light and moisture. While not classified as hazardous under normal handling conditions, proper laboratory safety protocols should always be followed when working with this chemical.

Future research directions for 3-methyl-5,6,7,8-tetrahydroquinoline include exploring its potential in materials science, particularly in the development of organic electronic materials and advanced polymers. The compound's electron-rich aromatic system and modifiable structure make it an interesting candidate for these emerging applications, which align with current search trends like "heterocyclic compounds in organic electronics."

In conclusion, 3-methyl-5,6,7,8-tetrahydroquinoline (CAS No. 28712-62-1) represents a valuable chemical building block with diverse applications across multiple industries. Its importance in pharmaceutical research, agrochemical development, and specialty chemical synthesis continues to grow, supported by ongoing research into its properties and potential uses. As scientific interest in nitrogen heterocycles and sustainable chemistry increases, this compound is likely to maintain its relevance in both academic and industrial settings.

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