1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-


Chemical Name: 1H-Indole-6-carboxylic acid, 2,3-dihydro-2-oxo-
CAS Number: 334952-09-9
Product Number: AG00BY6A(AGN-PC-0LXPHG)
Synonyms:
MDL No: MFCD01415801
Molecular Formula: C9H7NO3
Molecular Weight: 177.1568

Identification/Properties


Properties
BP:
438.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
177.159g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
177.043g/mol
Monoisotopic Mass:
177.043g/mol
Topological Polar Surface Area:
66.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
251
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-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Oxoindoline-6-carboxylic acid is a versatile compound widely utilized in chemical synthesis as a key building block for the preparation of various pharmaceutical and agrochemical intermediates. With its functional groups and unique chemical properties, this compound serves as a valuable precursor in the synthesis of a range of complex organic molecules.One of the primary applications of 2-Oxoindoline-6-carboxylic acid is in the synthesis of heterocyclic compounds, which are vital components in drug discovery and development. By incorporating this compound into synthetic routes, chemists can access diverse arrays of heterocyclic structures with potential biological activities. Furthermore, the presence of the carbonyl and carboxylic acid groups in 2-Oxoindoline-6-carboxylic acid allows for further derivatization, enabling the introduction of additional functionalities to tailor the properties of the target molecules.In addition to its role in heterocyclic synthesis, 2-Oxoindoline-6-carboxylic acid is also employed in the preparation of various building blocks used in medicinal chemistry. By strategically modifying the structure of this compound, chemists can access intermediates that are crucial for the synthesis of pharmaceutical agents targeting specific disease pathways. This versatility makes 2-Oxoindoline-6-carboxylic acid a valuable tool in the development of new drug candidates.Overall, the application of 2-Oxoindoline-6-carboxylic acid in chemical synthesis offers a pathway to access structurally diverse compounds with potential pharmaceutical and agrochemical applications. Its versatility and functionality make it a valuable asset in the toolbox of synthetic chemists working towards the discovery of novel molecules with therapeutic properties.