4-Thiazolecarboxylic acid, 2-amino-5-iodo-, ethyl ester


Chemical Name: 4-Thiazolecarboxylic acid, 2-amino-5-iodo-, ethyl ester
CAS Number: 860646-12-4
Product Number: AG008FJI(AGN-PC-07ASR1)
Synonyms:
MDL No:
Molecular Formula: C6H7IN2O2S
Molecular Weight: 298.1014

Identification/Properties


Computed Properties
Molecular Weight:
298.098g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
297.927g/mol
Monoisotopic Mass:
297.927g/mol
Topological Polar Surface Area:
93.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
181
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Ethyl 2-amino-5-iodothiazole-4-carboxylate is a valuable chemical compound widely utilized in chemical synthesis. It serves as a versatile building block in various organic reactions, particularly in the pharmaceutical and agrochemical industries. This compound is known for its ability to participate in coupling reactions, nucleophilic substitutions, and cyclization reactions, enabling the efficient synthesis of complex organic molecules. Additionally, Ethyl 2-amino-5-iodothiazole-4-carboxylate can be employed as a precursor in the preparation of diverse heterocyclic compounds with important biological activities. Its unique structure and reactivity make it a valuable tool for chemists looking to design and produce novel compounds with potential applications in drug discovery and other fields of research.