Butanedioic acid, (4-nitrophenyl)-


Chemical Name: Butanedioic acid, (4-nitrophenyl)-
CAS Number: 21021-53-4
Product Number: AG002KND(AGN-PC-0JOU1D)
Synonyms:
MDL No:
Molecular Formula: C10H9NO6
Molecular Weight: 239.1816

Identification/Properties


Properties
MP:
216-218℃
BP:
404.8°C at 760 mmHg
Form:
Solid
Computed Properties
Molecular Weight:
239.183g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
239.043g/mol
Monoisotopic Mass:
239.043g/mol
Topological Polar Surface Area:
120A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
315
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(4-Nitrophenyl)succinic acid is a key intermediate in chemical synthesis, often utilized for its versatile applications. This compound plays a crucial role in the production of various pharmaceuticals, agrochemicals, and specialty chemicals. Its functional groups offer unique reactivity and enable the formation of important derivatives through various synthesis routes. In organic synthesis, 2-(4-Nitrophenyl)succinic acid serves as a valuable building block for the creation of more complex molecules with tailored properties. Its ability to participate in diverse chemical transformations makes it a valuable tool in the hands of synthetic chemists. Whether utilized in the development of new materials or as a precursor for active pharmaceutical ingredients, this compound showcases its significance in the realm of chemical synthesis.