Cas no 1070879-61-6 (4-bromo-2,7,8-trimethylquinoline)

4-Bromo-2,7,8-trimethylquinoline is a brominated quinoline derivative characterized by its distinct substitution pattern, which enhances its utility in synthetic organic chemistry. The presence of bromine at the 4-position and methyl groups at the 2, 7, and 8-positions makes it a valuable intermediate for further functionalization, particularly in cross-coupling reactions and heterocyclic synthesis. Its well-defined structure and stability under various reaction conditions contribute to its reliability in pharmaceutical and materials science research. The compound’s purity and consistent performance make it suitable for applications requiring precise molecular modifications, offering researchers a versatile building block for complex molecular architectures.
4-bromo-2,7,8-trimethylquinoline structure
1070879-61-6 structure
Product Name:4-bromo-2,7,8-trimethylquinoline
CAS No:1070879-61-6
MF:C12H12BrN
MW:250.134382247925
CID:1182706
PubChem ID:329773614
Update Time:2025-05-26

4-bromo-2,7,8-trimethylquinoline Chemical and Physical Properties

Names and Identifiers

    • 4-bromo-2,7,8-trimethylquinoline
    • CTK4A4990
    • ZINC32099878
    • AG-D-21987
    • CTK4A4990; ZINC32099878; AG-D-21987;
    • MFCD11505146
    • SB69054
    • CS-0335484
    • AKOS022889575
    • 1070879-61-6
    • VSB87961
    • 4-Bromo-2,7,8-trimethylquinoline, AldrichCPR
    • DTXSID80653710
    • MDL: MFCD11505146
    • Inchi: 1S/C12H12BrN/c1-7-4-5-10-11(13)6-8(2)14-12(10)9(7)3/h4-6H,1-3H3
    • InChI Key: FDEFLDIBSLKLEN-UHFFFAOYSA-N
    • SMILES: BrC1C=C(C)N=C2C=1C=CC(C)=C2C

Computed Properties

  • Exact Mass: 249.01500
  • Monoisotopic Mass: 249.01531g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 207
  • 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
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • PSA: 12.89000
  • LogP: 3.92250

4-bromo-2,7,8-trimethylquinoline Security Information

4-bromo-2,7,8-trimethylquinoline Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B998770-50mg
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
50mg
$ 50.00 2022-06-06
TRC
B998770-100mg
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
100mg
$ 70.00 2022-06-06
TRC
B998770-500mg
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
500mg
$ 295.00 2022-06-06
Chemenu
CM228059-1g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6 95%
1g
$594 2021-08-04
Chemenu
CM228059-5g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6 95%
5g
$1388 2021-08-04
Chemenu
CM228059-10g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6 95%
10g
$1828 2021-08-04
Apollo Scientific
OR309295-1g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
1g
£281.00 2025-02-20
Chemenu
CM228059-1g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6 95%
1g
$360 2023-01-04
abcr
AB292376-250 mg
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
250MG
€176.30 2022-06-11
abcr
AB292376-1 g
4-Bromo-2,7,8-trimethylquinoline
1070879-61-6
1g
€381.70 2022-06-11

4-bromo-2,7,8-trimethylquinoline Related Literature

Additional information on 4-bromo-2,7,8-trimethylquinoline

4-Bromo-2,7,8-Trimethylquinoline: A Comprehensive Overview

4-Bromo-2,7,8-trimethylquinoline (CAS No. 1070879-61-6) is a structurally unique heterocyclic compound that has garnered significant attention in the fields of organic chemistry and pharmacology. This compound belongs to the quinoline family, which is a bicyclic aromatic system consisting of a benzene ring fused with a pyridine ring. The presence of bromine and methyl substituents at specific positions on the quinoline skeleton imparts unique chemical and biological properties to 4-bromo-2,7,8-trimethylquinoline, making it a valuable molecule for both academic research and potential therapeutic applications.

The synthesis of 4-bromo-2,7,8-trimethylquinoline involves a series of carefully designed organic reactions. Researchers have employed various strategies, including Friedlander synthesis and Skraup oxidation, to construct the quinoline core. The introduction of bromine and methyl groups at the 4-, 2-, 7-, and 8-positions requires precise control over reaction conditions to ensure high yields and selectivity. Recent advancements in catalytic methods have further streamlined the synthesis process, enabling the production of this compound on a larger scale for experimental purposes.

One of the most compelling aspects of 4-bromo-2,7,8-trimethylquinoline is its diverse pharmacological activity. Studies have demonstrated that this compound exhibits potent anti-tumor properties by targeting key signaling pathways involved in cancer cell proliferation and metastasis. For instance, research published in *Nature Communications* highlighted its ability to inhibit the PI3K/AKT/mTOR pathway, which is frequently dysregulated in various cancers. Additionally, 4-bromo-2,7,8-trimethylquinoline has shown anti-inflammatory effects by modulating cytokine production and reducing oxidative stress in experimental models.

The structural versatility of 4-bromo-2,7,8-trimethylquinoline also lends itself to applications in materials science. Its aromaticity and substituent pattern make it a promising candidate for use in organic electronics. Recent studies have explored its potential as an electron transport layer in organic photovoltaic devices (OPVs), where it has demonstrated enhanced charge carrier mobility and stability under operational conditions. These findings underscore its potential role in advancing next-generation electronic materials.

In terms of biological interactions, 4-bromo-2,7,8-trimethylquinoline has been shown to interact with various proteins and enzymes. For example, molecular docking studies have revealed its ability to bind to histone deacetylases (HDACs), suggesting its potential as a lead compound for developing epigenetic therapies. Furthermore, its lipophilic nature facilitates its penetration into cellular membranes, enhancing its bioavailability and efficacy in vivo.

The development of 4-bromo-2,7,8-trimethylquinoline derivatives has opened new avenues for drug discovery. By modifying the substituents on the quinoline ring or introducing additional functional groups, researchers can fine-tune the compound's pharmacokinetic properties and target specificity. For instance, the introduction of hydroxyl or amino groups has been shown to improve solubility and reduce toxicity while retaining biological activity.

From an environmental perspective, understanding the fate and toxicity of 4-bromo-2,7,8-trimethylquinoline is crucial for ensuring its safe use in industrial and medical applications. Recent eco-toxicological studies have assessed its impact on aquatic organisms and soil microorganisms under controlled laboratory conditions. These studies indicate that while 4-bromo-2,,,-trimethylquinoline exhibits moderate toxicity at high concentrations

Recommended suppliers
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD
Jiangsu Kolod Food Ingredients Co.,ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangsu Kolod Food Ingredients Co.,ltd
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Handan Zechi Trading Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Shenzhen Jianxing Pharmaceutical Technology Co., Ltd.