1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-


Chemical Name: 1H-Pyrrolo[2,3-b]pyridine-5-carboxylic acid, 1-methyl-
CAS Number: 934568-20-4
Product Number: AG0062M5(AGN-PC-086EAR)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O2
Molecular Weight: 176.1720

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
176.175g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
176.059g/mol
Monoisotopic Mass:
176.059g/mol
Topological Polar Surface Area:
55.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
220
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-Methyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid, also known as $name$, is a versatile compound widely utilized in chemical synthesis. This compound serves as a crucial building block in the creation of various pharmaceuticals, agrochemicals, and organic materials. Due to its unique structural properties, $name$ plays a significant role as a key intermediate in the synthesis of diverse molecular entities. Its functional groups and reactivity make it an essential component in the construction of complex molecular frameworks through sequential chemical transformations. In particular, the incorporation of $name$ allows for the introduction of specific functionalities and stereochemical elements into the target molecules, facilitating the development of novel compounds with potential applications in drug discovery and material science. Furthermore, the strategic use of $name$ in chemical synthesis enables chemists to access a diverse array of molecular architectures, thereby broadening the scope of synthetic possibilities and expanding the frontier of chemical innovation.