Cas no 3336-49-0 (Isoquinolin-4-ol)

Isoquinolin-4-ol structure
Isoquinolin-4-ol structure
Product Name:Isoquinolin-4-ol
CAS No:3336-49-0
MF:C9H7NO
MW:145.157982110977
MDL:MFCD00234514
CID:311853
PubChem ID:18750
Update Time:2025-11-01

Isoquinolin-4-ol Chemical and Physical Properties

Names and Identifiers

    • 4-&#24322
    • Isoquinolin-4-ol
    • &#21945
    • &#21833
    • 4-Hydroxyisoquinoline
    • 4-Hydroxyquinoline
    • 4-Isoquinolinol
    • 3-hydroxyisoquinoline
    • 4-Hydroxy-isochinolin
    • 4-Isoquinolol
    • Isochinolin-4-ol
    • MFCD00234514
    • AMY4404
    • SB12152
    • FT-0659691
    • BRN 0114428
    • AC-907/25004895
    • 4-HYDROXY-ISOQUINOLINE
    • J-019163
    • DTXSID20186976
    • SY041595
    • A821745
    • SCHEMBL276819
    • PS-5256
    • NSC-153682
    • NSC153682
    • AKOS006280509
    • 5-21-03-00321 (Beilstein Handbook Reference)
    • EN300-120932
    • NSC 153682
    • FT-0651841
    • 4-oxidoisoquinolinium
    • 3336-49-0
    • 33364-92-0
    • CS-W019920
    • BCP23455
    • FSA7EJB9BG
    • FT-0645218
    • Z1198152661
    • AB05248
    • J-521570
    • A26437
    • UNII-FSA7EJB9BG
    • 4-hydroxyisoquinoline, AldrichCPR
    • DTXCID60109467
    • isoquinoline, 4-hydroxy-
    • DB-082508
    • DB-028919
    • MDL: MFCD00234514
    • Inchi: 1S/C9H7NO/c11-9-6-10-5-7-3-1-2-4-8(7)9/h1-6,11H
    • InChI Key: DXTUTXYCHFWRQC-UHFFFAOYSA-N
    • SMILES: OC1=CN=CC2C=CC=CC=21

Computed Properties

  • Exact Mass: 145.05300
  • Monoisotopic Mass: 145.053
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 138
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 1.7
  • Topological Polar Surface Area: 33.1A^2

Experimental Properties

  • Density: 1.26
  • Melting Point: 223-225 oC
  • Boiling Point: 425.4°C at 760 mmHg
  • Flash Point: 211.1°C
  • PSA: 33.12000
  • LogP: 1.94040

Isoquinolin-4-ol Security Information

Isoquinolin-4-ol Customs Data

  • HS CODE:2933499090
  • Customs Data:

    China Customs Code:

    2933499090

    Overview:

    2933499090. Other compounds containing quinoline or isoquinoline ring system [but not further fused]. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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Isoquinolin-4-ol Production Method

Isoquinolin-4-ol Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:3336-49-0)Isoquinolin-4-ol
Order Number:A821745
Stock Status:in Stock
Quantity:10g/25g
Purity:99%
Pricing Information Last Updated:Monday, 2 September 2024 16:09
Price ($):161.0/402.0

Isoquinolin-4-ol Related Literature

Additional information on Isoquinolin-4-ol

Isoquinolin-4-ol (CAS No. 3336-49-0): An Overview of Its Properties, Applications, and Recent Research

Isoquinolin-4-ol (CAS No. 3336-49-0) is a versatile compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound, also known as 4-hydroxyisoquinoline, is a derivative of isoquinoline, a heterocyclic aromatic organic compound with a wide range of biological activities. The unique structure of Isoquinolin-4-ol makes it an attractive candidate for various applications, including drug discovery and development.

The chemical structure of Isoquinolin-4-ol consists of a benzene ring fused with a pyridine ring, with a hydroxyl group attached to the fourth position of the isoquinoline ring. This arrangement confers the compound with specific chemical properties that are crucial for its biological activities. The hydroxyl group can participate in hydrogen bonding and other interactions, making Isoquinolin-4-ol a potent ligand for various biological targets.

In recent years, extensive research has been conducted to explore the potential therapeutic applications of Isoquinolin-4-ol. One of the most promising areas of research is its role as an antioxidant and anti-inflammatory agent. Studies have shown that Isoquinolin-4-ol exhibits strong antioxidant properties, which can help protect cells from oxidative stress and damage caused by reactive oxygen species (ROS). This property makes it a potential candidate for treating various diseases associated with oxidative stress, such as neurodegenerative disorders and cardiovascular diseases.

Moreover, Isoquinolin-4-ol has been found to possess anti-inflammatory effects. Inflammatory responses are often involved in the pathogenesis of many chronic diseases, including arthritis and inflammatory bowel disease (IBD). Research has demonstrated that Isoquinolin-4-ol can inhibit the production of pro-inflammatory cytokines and reduce inflammation in both in vitro and in vivo models. These findings suggest that Isoquinolin-4-ol could be developed into a novel anti-inflammatory drug.

Beyond its antioxidant and anti-inflammatory properties, Isoquinolin-4-ol has also shown promise in cancer research. Several studies have reported that Isoquinolin-4-ol can induce apoptosis (programmed cell death) in cancer cells while sparing normal cells. This selective cytotoxicity is highly desirable in cancer therapy, as it can minimize side effects associated with conventional chemotherapy. Additionally, Isoquinolin-4-ol has been found to inhibit the proliferation of cancer cells by interfering with key signaling pathways involved in cell growth and survival.

The pharmacokinetic properties of Isoquinolin-4-ol have also been investigated to assess its potential as a therapeutic agent. Studies have shown that it has good oral bioavailability and can be effectively absorbed into the bloodstream after oral administration. Furthermore, it exhibits favorable metabolic stability and low toxicity, making it suitable for long-term use in clinical settings.

In addition to its therapeutic applications, Isoquinolin-4-ol has been explored for its use in diagnostic imaging. Due to its ability to bind to specific biomarkers, it can be used as a contrast agent in imaging techniques such as magnetic resonance imaging (MRI) and positron emission tomography (PET). This application could enhance the accuracy and sensitivity of diagnostic procedures, leading to better patient outcomes.

The synthesis of Isoquinolin-4-ol has been optimized through various methods to improve yield and purity. Common synthetic routes include Pictet-Spengler condensation followed by hydrolysis or reduction steps. These methods have been refined to ensure high efficiency and scalability, making large-scale production feasible for industrial applications.

In conclusion, Isoquinolin-4-ol (CAS No. 3336-49-0) is a multifaceted compound with significant potential in medicinal chemistry and pharmaceutical research. Its unique chemical structure confers it with diverse biological activities, including antioxidant, anti-inflammatory, and anticancer properties. Ongoing research continues to uncover new applications and mechanisms of action for this compound, highlighting its importance in the development of novel therapeutic agents. As more studies are conducted, Isoquinolin-4-ol is likely to play an increasingly important role in advancing medical treatments and improving patient care.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:3336-49-0)Isoquinolin-4-ol
A821745
Purity:99%/99%
Quantity:10g/25g
Price ($):161.0/402.0
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