Cas no 107430-96-6 (4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde)

4,4-Dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde is a versatile intermediate in organic synthesis, particularly valued for its benzopyran scaffold, which is a key structural motif in pharmaceuticals and fine chemicals. The aldehyde functional group at the 6-position offers reactivity for further derivatization, enabling the synthesis of diverse heterocyclic compounds. Its 4,4-dimethyl substitution enhances stability, reducing unwanted side reactions during transformations. This compound is useful in medicinal chemistry for developing bioactive molecules, including potential therapeutic agents. Its well-defined structure and purity make it suitable for research applications requiring precise molecular frameworks. Handling should adhere to standard safety protocols for aldehydes and aromatic compounds.
4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde structure
107430-96-6 structure
Product Name:4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde
CAS No:107430-96-6
MF:C12H14O2
MW:190.238363742828
MDL:MFCD17215725
CID:2123820
PubChem ID:18983619
Update Time:2025-08-02

4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde Chemical and Physical Properties

Names and Identifiers

    • 4,4-dimethylchroman-6-carbaldehyde
    • 4,4-dimethyl-2,3-dihydrochromene-6-carbaldehyde
    • 4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde
    • 4,4-dimethyl-3,4-dihydro-2H-chromene-6-carbaldehyde
    • DTXCID70547871
    • CS-0440498
    • 2H-1-Benzopyran-6-carboxaldehyde, 3,4-dihydro-4,4-dimethyl-
    • 4,4-Dimethylchromane-6-carbaldehyde
    • EN300-2689122
    • LSCGMDNTBSLEER-UHFFFAOYSA-N
    • 107430-96-6
    • 973-403-0
    • SCHEMBL289444
    • 4,4-dimethyl-3,4-dihydro-2H-chromene-6-carboxaldehyde
    • HEA43096
    • MFCD17215725
    • Z1255448899
    • DTXSID90597111
    • DA-15823
    • MDL: MFCD17215725
    • Inchi: 1S/C12H14O2/c1-12(2)5-6-14-11-4-3-9(8-13)7-10(11)12/h3-4,7-8H,5-6H2,1-2H3
    • InChI Key: LSCGMDNTBSLEER-UHFFFAOYSA-N
    • SMILES: O1C2C=CC(C=O)=CC=2C(C)(C)CC1

Computed Properties

  • Exact Mass: 190.099379685g/mol
  • Monoisotopic Mass: 190.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 222
  • 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: 2.6
  • Topological Polar Surface Area: 26.3?2

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Additional information on 4,4-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbaldehyde

4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde: A Comprehensive Overview

4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde (CAS No. 107430-96-6) is a structurally unique organic compound that has garnered significant attention in the fields of organic synthesis, materials science, and pharmacology. This compound belongs to the class of benzopyrans, which are known for their versatile applications in various scientific domains. The molecule's structure comprises a benzopyran skeleton with a methyl group at the 4-position and an aldehyde group at the 6-position. This combination of functional groups imparts unique chemical properties and reactivity, making it a valuable compound for both academic and industrial research.

The synthesis of benzopyran derivatives has been extensively studied due to their potential as intermediates in the construction of complex molecules. Recent advancements in catalytic methods have enabled more efficient and selective syntheses of benzopyran-based compounds, including 4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde. For instance, researchers have employed transition metal-catalyzed cyclization reactions to construct the benzopyran framework with high regioselectivity. These methods not only simplify the synthesis process but also pave the way for large-scale production of such compounds.

In the realm of materials science, benzopyran derivatives have shown promise as building blocks for advanced materials. The aldehyde group in 4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde can undergo various condensation reactions to form conjugated systems with enhanced electronic properties. Recent studies have explored the use of this compound in the development of organic semiconductors and light-emitting materials. For example, by incorporating this benzopyran derivative into polymer frameworks, researchers have achieved improved charge transport properties and enhanced photoluminescence efficiency.

The pharmacological potential of benzopyran derivatives has also been a focal point of recent research. 4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde has been investigated for its bioactivity against various disease models. Preclinical studies have demonstrated its potential as an anti-inflammatory agent by modulating key inflammatory pathways. Additionally, this compound has shown selective cytotoxicity against cancer cells in vitro, suggesting its potential as a lead compound for anticancer drug development.

In terms of analytical chemistry, the characterization of benzopyran derivatives has benefited from advancements in spectroscopic techniques. High-resolution mass spectrometry (HRMS) and nuclear magnetic resonance (NMR) spectroscopy have been instrumental in confirming the structure and purity of 4,4-Dimethyl-3,4-Dihydro-2H-1-Benzopyran-6-Carbaldehyde. These techniques provide valuable insights into the molecular interactions and stability of the compound under different conditions.

From an environmental perspective, understanding the fate and toxicity of benzopyran derivatives is crucial for their safe application. Recent studies have assessed the biodegradation potential of benzopyran derivatives, including CAS No. 107430-96-X, under various environmental conditions. Results indicate that these compounds can undergo microbial degradation under aerobic conditions, reducing their persistence in natural ecosystems.

In conclusion, CAS No 10743096X, or benzaldehyde derivative, stands out as a versatile compound with diverse applications across multiple scientific disciplines. Its unique structure and functional groups make it an invaluable tool for researchers aiming to develop novel materials and therapeutic agents. As research continues to uncover new properties and applications of this compound,the future prospects for CAS No 10743096X remain bright.

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