Decoquinate


Chemical Name: Decoquinate
CAS Number: 18507-89-6
Product Number: AG00I1J8(AGN-PC-0WAMKY)
Synonyms:
MDL No: MFCD00673686
Molecular Formula: C24H35NO5
Molecular Weight: 417.5384

Identification/Properties


Computed Properties
Molecular Weight:
417.546g/mol
XLogP3:
6.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
15
Exact Mass:
417.252g/mol
Monoisotopic Mass:
417.252g/mol
Topological Polar Surface Area:
73.9A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
562
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



Ethyl 4-hydroxy-6-(decyloxy)-7-ethoxyquinoline-3-carboxylate is a versatile compound used in chemical synthesis for its unique structural properties. As a quinoline derivative, it serves as a valuable building block in the creation of pharmaceuticals and agrochemicals. Its hydroxy and carboxylic acid groups make it a key intermediate in the synthesis of bioactive compounds and potential drug candidates. Additionally, the ethyl and ethoxy substituents enhance its solubility and compatibility in various reactions, allowing for efficient transformations in organic synthesis. With its specific molecular structure, Ethyl 4-hydroxy-6-(decyloxy)-7-ethoxyquinoline-3-carboxylate offers a wide range of possibilities for the development of new molecules with desired properties and functions.