methyl 1H-pyrrolo[3,2-b]pyridine-3-carboxylate


Chemical Name: methyl 1H-pyrrolo[3,2-b]pyridine-3-carboxylate
CAS Number: 952800-39-4
Product Number: AG006O4H(AGN-PC-07A7OG)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O2
Molecular Weight: 176.1720

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
176.175g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
176.059g/mol
Monoisotopic Mass:
176.059g/mol
Topological Polar Surface Area:
55A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
208
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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NMR Spectrum


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Chemical Structure



Methyl 1H-pyrrolo[3,2-b]pyridine-3-carboxylate is a key intermediate that plays a crucial role in chemical synthesis. This compound serves as a versatile building block in the creation of various pharmaceuticals, agrochemicals, and materials due to its unique structural properties. By acting as a precursor in multistep synthesis processes, this compound enables the production of complex molecules with specific functionalities. Its inclusion in reactions allows for the introduction of pyrrolopyridine motifs, which are essential for the development of bioactive compounds and intricate molecular structures. Furthermore, Methyl 1H-pyrrolo[3,2-b]pyridine-3-carboxylate demonstrates high reactivity and selectivity, making it a valuable tool for chemists in designing and constructing novel chemical entities for a wide range of applications.