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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

3-Thiophenecarboxylic acid, 2-(acetylamino)-, methyl ester

COC(=O)c1ccsc1NC(=O)C Request for Quotation
Chemical Name: 3-Thiophenecarboxylic acid, 2-(acetylamino)-, methyl ester
CAS Number: 22288-81-9
Product Number: AG00C242(AGN-PC-0KLGG1)
Synonyms:
MDL No:
Molecular Formula: C8H9NO3S
Molecular Weight: 199.2270

Identification/Properties

Computed Properties
Molecular Weight:
199.224g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
199.03g/mol
Monoisotopic Mass:
199.03g/mol
Topological Polar Surface Area:
83.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
219
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


Methyl 2-(acetylamino)-3-thiophenecarboxylate is a versatile compound commonly used in chemical synthesis for its unique reactivity and functional group compatibility. This compound serves as a valuable building block for the synthesis of various biologically active molecules, pharmaceuticals, and agrochemicals.In organic synthesis, Methyl 2-(acetylamino)-3-thiophenecarboxylate can participate in a range of reactions, such as acylation, amidation, and cross-coupling reactions, to introduce the acetylamine and thiophenecarboxylate groups into target molecules. Additionally, the presence of both the ester and amide functionalities in this compound provides opportunities for further diversification through selective functional group transformations.Furthermore, the thiophene ring in Methyl 2-(acetylamino)-3-thiophenecarboxylate imparts unique electronic and aromatic properties to the molecule, making it an attractive scaffold for the design and synthesis of heterocyclic compounds with potential biological activities.Overall, Methyl 2-(acetylamino)-3-thiophenecarboxylate is a valuable reagent in organic synthesis, allowing for the efficient construction of structurally diverse compounds with interesting properties for various applications in medicinal chemistry and materials science.