Trifluoroacetamide - ≥97% , CAS No.354-38-1

CAS: 354-38-1 Cat. No.: T110544 Formula: C₂H₂F₃NO Molecular Weight: 113.04 Beilstein Registry Number: 1753625 EC Number: 206-559-9 PubChem CID: 67717

GRADE & PURITY ≥97%

Synonyms

BDBM50226184 | Trifluoroacetamide | trifluoro-acetamide | TRIFLUOROACETAMIDINE,TECH. | Q27256578 | N-trifluoroacetamide | STL146458 | trifluroacetamide | T0598 | AKOS005207149 | EN300-19421 | F0001-1023 | NSC 9449 | trifluoroacetic acid amide | UNII-36MU1

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

It is a good quencher of tryptophan fluorescence.
It was used as probe for determination of membrane potential and extra/intracellular volume of erythrocytes by fluorine-19 NMR studies.

Specifications

Synonyms

BDBM50226184 | Trifluoroacetamide | trifluoro-acetamide | TRIFLUOROACETAMIDINE,TECH. | Q27256578 | N-trifluoroacetamide | STL146458 | trifluroacetamide | T0598 | AKOS005207149 | EN300-19421 | F0001-1023 | NSC 9449 | trifluoroacetic acid amide | UNII-36MU1

Specifications & Purity

≥97%

Storage

Room temperature,Argon charged

Shipped In

Normal

Purity

≥97%

Names and Identifiers

• Pubchem Sid: 488183998
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488183998
• Canonical Smiles: C(=O)(C(F)(F)F)N
• IUPAC Name: 2,2,2-trifluoroacetamide
• InChIKey: NRKYWOKHZRQRJR-UHFFFAOYSA-N
• INCHI: 1S/C2H2F3NO/c3-2(4,5)1(6)7/h(H2,6,7)
• Isomeric SMILES: C(=O)(C(F)(F)F)N
• WGK Germany: 3
• PubChem CID: 67717
• Molecular Weight: 113.04
• Beilstein: 1753625
• Reaxy-Rn: 1753625

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Primary carboxylic acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Primary carboxylic acid amides
• Alternative Parents: Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Primary carboxylic acid amide - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as primary carboxylic acid amides. These are compounds comprising primary carboxylic acid amide functional group, with the general structure RC(=O)NH2.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Soluble in water (460 mg/ml), alcohol, ether, chloroform (partially), and methanol.
• Sensitivity: Moisture sensitive.
• Boil Point(°C): 162.5°C
• Melt Point(°C): 75°C
• Molecular Weight: 113.040 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 113.009 Da
• Monoisotopic Mass: 113.009 Da
• Topological Polar Surface Area: 43.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 85.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Frequently Asked Questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 354-38-1, the molecular formula is C2H2F3NO, and the molecular weight is 113.04 g/mol. InChIKey NRKYWOKHZRQRJR-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.