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Home  > Chemistry  > Heterocyclic Building Blocks  > Other Aromatic Heterocycles  > (Z)-2-(11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid

AA12434

113806-05-6 | (Z)-2-(11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid

Packsize Purity Availability Price Discounted Price    Quantity
5mg 98% in stock $80.00 $56.00 -   +
25mg 98% in stock $309.00 $217.00 -   +

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Description
Catalog Number: AA12434
Chemical Name: (Z)-2-(11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid
CAS Number: 113806-05-6
Molecular Formula: C21H23NO3
Molecular Weight: 337.4122
MDL Number: MFCD00865645
SMILES: CN(CC/C=C/1c2cc(ccc2OCc2c1cccc2)CC(=O)O)C

 

Computed Properties
Complexity: 488  
Covalently-Bonded Unit Count: 1  
Defined Bond Stereocenter Count: 1  
Heavy Atom Count: 25  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 5  
XLogP3: 1.5  

 

 

Upstream Synthesis Route 
  • The compound (Z)-2-(11-(3-(Dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid, hereinafter referred to as $name$, exhibits unique properties that make it a valuable tool in chemical synthesis. $name$ is commonly used as a key building block in the creation of complex organic molecules. Its structural characteristics allow it to participate in a variety of chemical reactions, serving as a versatile intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Specifically, $name$ can act as a precursor for the formation of novel heterocyclic compounds through various synthetic routes. By functionalizing different parts of the molecule, chemists can tailor the reactivity and properties of the final products. Additionally, the presence of the dimethylamino group enables $name$ to engage in a range of nucleophilic and acidic reactions, expanding its synthetic utility further.When incorporated into synthetic schemes, $name$ imparts its distinct molecular framework and functional groups, facilitating the construction of diverse chemical structures with specific biological or material properties. This compound thus plays a crucial role in the development of cutting-edge compounds with potential applications in drug discovery, materials science, and other scientific endeavors.
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