2-Quinolinecarboxylic acid, 4-chloro-, methyl ester


Chemical Name: 2-Quinolinecarboxylic acid, 4-chloro-, methyl ester
CAS Number: 114935-92-1
Product Number: AG000FGG(AGN-PC-0267WZ)
Synonyms:
MDL No:
Molecular Formula: C11H8ClNO2
Molecular Weight: 221.6397

Identification/Properties


Computed Properties
Molecular Weight:
221.64g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
221.024g/mol
Monoisotopic Mass:
221.024g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
247
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl 4-chloroquinoline-2-carboxylate is a valuable chemical intermediate commonly utilized in chemical synthesis processes. Its unique molecular structure makes it well-suited for various applications within the field of organic chemistry. One prominent use of this compound is as a starting material for the synthesis of diverse quinoline derivatives, which are key components in the creation of pharmaceuticals, agrochemicals, and functional materials. By serving as a building block in organic synthesis, Methyl 4-chloroquinoline-2-carboxylate enables the production of compounds with specific structural features and desired properties, facilitating the development of new molecules with potential applications across a range of industries.