115957-22-7

Basic information

• Product Name: 3-(2-THIENYL)-3-[(2,2,2-TRIFLUOROACETYL)AMINO]PROPANOIC ACID
• Synonyms: 3-(2-THIENYL)-3-[(2,2,2-TRIFLUOROACETYL)AMINO]PROPANOIC ACID;3-(Thien-2-yl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid;3-(Thiophen-2-yl)-3-(2,2,2-trifluoroacetaMido)propanoic acid
• CAS NO: 115957-22-7
• Molecular Formula: C9H8F3NO3S
• Molecular Weight: 267.22
• Mol File: 115957-22-7.mol

Chemical Properties

• Melting Point: 154-157°C
• Boiling Point: 411.2°Cat760mmHg
• Flash Point: 202.5°C
• Appearance: /
• Density: 1.493g/cm³
• Vapor Pressure: 1.69E-07mmHg at 25°C
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 3-(2-THIENYL)-3-[(2,2,2-TRIFLUOROACETYL)AMINO]PROPANOIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-THIENYL)-3-[(2,2,2-TRIFLUOROACETYL)AMINO]PROPANOIC ACID(115957-22-7)
• EPA Substance Registry System: 3-(2-THIENYL)-3-[(2,2,2-TRIFLUOROACETYL)AMINO]PROPANOIC ACID(115957-22-7)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 115957-22-7(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
3-(2-Thienyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to modulate biological processes. It contributes to the development of drugs targeting a range of diseases and disorders, enhancing treatment options and improving patient outcomes.
Used in Agrochemical Industry:
In the agrochemical sector, 3-(2-Thienyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid serves as a crucial component in the creation of pesticides and other crop protection agents. Its incorporation aids in the management of pests and diseases, ensuring increased crop yields and agricultural productivity.
Used as a Research Tool in Chemistry:
3-(2-Thienyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid is utilized as a research tool in chemical studies, particularly for investigating chemical reactions and mechanisms. Its unique structure and properties make it instrumental in advancing scientific understanding and facilitating the discovery of new chemical compounds and processes.

InChI:InChI=1/C9H8F3NO3S/c10-9(11,12)8(16)13-5(4-7(14)15)6-2-1-3-17-6/h1-3,5H,4H2,(H,13,16)(H,14,15)/p-1/t5-/m1/s1

Upstream product

• 18389-46-3 3-amino-3-(thiophen-2-yl)propanoic acid 
• 407-25-0 trifluoroacetic anhydride 
• 98-03-3 thiophene-2-carbaldehyde 

Downstream Products

• 194229-21-5 3-(5-bromo-2-thienyl)-3-[(2,2,2-trifluoroacetyl)amino]propanoic acid 

Relevant articles and documents

Aminothiaindanone as an Accessible Scaffold for a Three-Point Chemical Diversity

Aminothiaindanone heterocycle appears to be a scaffold of interest in medicinal chemistry. To increase the chemical diversity in this series, the introduction of three-point chemical diversity on the cyclopenta[ b ]thiophen-4-one scaffold was explored. About thirty newly functionalized thiophene-containing bicycles were obtained using various chemical reactions, paving the way for novel possibilities in medicinal chemistry projects.

An expedient synthesis of 6-arylpiperidine-2,4-diones by chain-extension of β-aryl-β-aminoacids

The synthesis of novel 6-arylpiperidine-2,4-diones is described in five steps starting from β-aryl-β-aminoacids via the chain extension of the latter into δ-aryl-δ-amino-β-ketoacids. The chemical pathway involves an acylation of Meldrum's acid and yields useful building blocks for heterocyclic chemistry.

Efficient synthesis of 2-aryl-6-methyl-2,3-dihydro-1H-pyridin-4-ones

Syntheses of 2-aryl-6-methyl-2,3-dihydro-1H-pyridin-4-ones were achieved starting from corresponding β-arylβ-amino acids. This reaction sequence involved, as a key step, the condensation of an acid chloride with a diketone using SmI3 as catalyst. A final intramolecular cyclization furnished the attempted product. (C) 2000 Elsevier Science Ltd.

A CONVENIENT ROUTE TO 6-AMINOCYCLOPENTATHIOPHENE DERIVATIVES

The intramolecular cyclization of 3-amino-3-(2-thienyl) propionic acid to 6-amino-5,6-dihydrocyclopentathiophene was achevied by Friedel-Crafts reaction.