Benzoic acid, 4-amino-2-hydroxy-, monosodium salt


Chemical Name: Benzoic acid, 4-amino-2-hydroxy-, monosodium salt
CAS Number: 133-10-8
Product Number: AG0011HI(AGN-PC-0PJWHD)
Synonyms:
MDL No:
Molecular Formula: C7H6NNaO3
Molecular Weight: 175.1172

Identification/Properties


Computed Properties
Molecular Weight:
175.119g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
175.025g/mol
Monoisotopic Mass:
175.025g/mol
Topological Polar Surface Area:
86.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
165
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Sodium 4-Aminosalicylate is a versatile chemical compound commonly utilized in chemical synthesis as a key building block for various organic reactions. Its application in the synthesis of pharmaceuticals and agrochemicals is particularly notable due to its unique properties and reactivity. Acting as a nucleophilic aromatic substitution reagent, Sodium 4-Aminosalicylate plays a crucial role in the formation of important carbon-carbon and carbon-nitrogen bonds. Additionally, its ability to undergo further derivatization makes it a valuable precursor for the development of novel compounds with diverse functionalities. In the realm of chemical synthesis, Sodium 4-Aminosalicylate serves as an essential tool for the creation of complex molecular structures with potential applications in the fields of medicine, agriculture, and materials science.