4-Quinolinecarboxylic acid, methyl ester


Chemical Name: 4-Quinolinecarboxylic acid, methyl ester
CAS Number: 21233-61-4
Product Number: AG00BH2J(AGN-PC-0KNPG4)
Synonyms:
MDL No:
Molecular Formula: C11H9NO2
Molecular Weight: 187.1947

Identification/Properties


Computed Properties
Molecular Weight:
187.198g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
187.063g/mol
Monoisotopic Mass:
187.063g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
217
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

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl quinoline-4-carboxylate plays a crucial role in chemical synthesis as a versatile building block for the creation of various compounds. Its unique structure allows for the easy modification and manipulation of its chemical properties, making it a valuable tool for synthetic chemists. By incorporating methyl quinoline-4-carboxylate into reactions, chemists can access a diverse range of molecules with desired functionalities and structures. This compound serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals, making it an essential component in the toolbox of synthetic chemists striving to develop novel and impactful compounds.