3-Thiophenecarboxylic acid, 2-amino-5-methyl-, methyl ester


Chemical Name: 3-Thiophenecarboxylic acid, 2-amino-5-methyl-, methyl ester
CAS Number: 19369-53-0
Product Number: AG0074YY(AGN-PC-0JUSC5)
Synonyms:
MDL No:
Molecular Formula: C7H9NO2S
Molecular Weight: 171.2169

Identification/Properties


Computed Properties
Molecular Weight:
171.214g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
171.035g/mol
Monoisotopic Mass:
171.035g/mol
Topological Polar Surface Area:
80.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
163
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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Chemical Structure



Methyl 2-amino-5-methylthiophene-3-carboxylate, a versatile compound in chemical synthesis, serves as a key building block in the creation of various complex molecules. This compound's strategic placement of functional groups allows for facile manipulation and introduction of desired chemical moieties. In organic synthesis, it can be utilized as a precursor in the preparation of bioactive compounds, pharmaceuticals, and advanced materials. Its unique structural attributes make it a valuable component in the development of novel drug candidates and agrochemicals. Additionally, Methyl 2-amino-5-methylthiophene-3-carboxylate plays a pivotal role in the synthesis of heterocyclic compounds with diverse applications in medicinal chemistry and material science. This compound's versatility and reactivity open up a myriad of possibilities for synthesizing compounds with tailored properties and functions.