structure of Methyl 2-(5-cyanobenzo[B]thiophen-2-YL)acetate

Methyl 2-(5-cyanobenzo[B]thiophen-2-YL)acetate

CAS No.: 1000340-05-5
M. Wt: 231.27
M. Fa: C12H9NO2S
InChI Key: BZPAQSYXZNZBBG-UHFFFAOYSA-N

Names and Identifiers of 1000340-05-5

CAS Number

1000340-05-5

MDL Number

MFCD09910410

IUPAC Name

methyl 2-(5-cyano-1-benzothiophen-2-yl)acetate

InChI

InChI=1S/C12H9NO2S/c1-15-12(14)6-10-5-9-4-8(7-13)2-3-11(9)16-10/h2-5H,6H2,1H3

InChIKey

BZPAQSYXZNZBBG-UHFFFAOYSA-N

Canonical SMILES

COC(=O)CC1=CC2=C(S1)C=CC(=C2)C#N

UNSPSC Code

12352100

Physical and chemical properties of 1000340-05-5

Molecular Formula

C12H9NO2S

Molecular Weight

231.27

Safety Information of 1000340-05-5

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000340-05-5

Methyl 2-(5-cyanobenzo[B]thiophen-2-YL)acetate has potential applications in various fields:

  • Pharmaceuticals: Due to its structural characteristics, it may serve as a lead compound for developing new drugs targeting cancer or infectious diseases.
  • Material Science: Its unique electronic properties could be harnessed in organic electronics or as a precursor in synthesizing advanced materials.
  • Chemical Research: It can be used as a reagent in organic synthesis or as a building block for creating more complex molecules.

Biological Activity of 1000340-05-5

  • Antimicrobial: Thiophene derivatives have been shown to possess antimicrobial properties.
  • Anticancer: Some benzo[b]thiophene derivatives are explored for their anticancer activities due to their ability to interfere with cellular processes.

Further research is necessary to elucidate the specific biological effects of this compound.