1H-Indole-3-carboxylic acid, 5-fluoro-, methyl ester


Chemical Name: 1H-Indole-3-carboxylic acid, 5-fluoro-, methyl ester
CAS Number: 310886-79-4
Product Number: AG00322Z(AGN-PC-0NP8NB)
Synonyms:
MDL No:
Molecular Formula: C10H8FNO2
Molecular Weight: 193.1744

Identification/Properties


Properties
MP:
200-202℃
BP:
335.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
193.177g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
193.054g/mol
Monoisotopic Mass:
193.054g/mol
Topological Polar Surface Area:
42.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
234
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


NMR Spectrum


Other Analytical Data


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Chemical Structure



Methyl 5-fluoro-1H-indole-3-carboxylate is a versatile compound widely used in chemical synthesis for various applications. In organic chemistry, it serves as a key building block in the preparation of pharmaceuticals, agrochemicals, and functional materials. Its unique structure and reactivity make it a valuable intermediate in the synthesis of complex molecules. By incorporating Methyl 5-fluoro-1H-indole-3-carboxylate into multi-step synthesis processes, chemists can access diverse chemical space and develop novel compounds with tailored properties. This compound's role in chemical synthesis highlights its importance in the discovery and development of new materials and bioactive compounds.