Triflusal - ≥99% , CAS No.322-79-2

CAS: 322-79-2 Cat. No.: T129348 Summenformel: C₁₀H₇F₃O₄ Molekulargewicht: 248.16 EG-Nummer: 206-297-5 PubChem CID: 9458

GRADE & PURITY ≥99%

Synonyms

Aflen | AKOS015890393 | SCHEMBL136423 | 2-Acetoxy-4-trifluoromethylbenzoic acid | 2-Acetoxy-4-trifluoromethyl-benzoic acid | AS-63983 | BSPBio_000515 | EN300-18567716 | Prestwick2_000528 | TRIFLUSAL [MART.] | Triflux | D07142 | Prestwick1_000528 | Triflus

Storage

Lagerung bei -20°C

Shipped In

Eistruhe + Eispads

Specifications

Synonyme

Aflen | AKOS015890393 | SCHEMBL136423 | 2-Acetoxy-4-trifluoromethylbenzoic acid | 2-Acetoxy-4-trifluoromethyl-benzoic acid | AS-63983 | BSPBio_000515 | EN300-18567716 | Prestwick2_000528 | TRIFLUSAL [MART.] | Triflux | D07142 | Prestwick1_000528 | Triflus

Spezifikationen & Reinheit

≥99%

Biochemische und physiologische Mechanismen

COX-1-Hemmer. Reduziert die COX-2-Expression. Zeigt in vivo thrombozytenaggregationshemmende, antiischämische und entzündungshemmende Wirkungen. Oral aktiv.

Storage

Lagerung bei -20°C

Verschickt in

Eistruhe + Eispads

Hinweis

Wenn möglich, sollten Sie die Lösungen noch am selben Tag zubereiten und verwenden. Wenn Sie jedoch Stammlösungen im Voraus herstellen müssen, empfehlen wir Ihnen, die Lösung als Aliquote in dicht verschlossenen Fläschchen bei -20 °C zu lagern. Diese sind in der Regel bis zu einem Monat haltbar. Vor der Verwendung und vor dem Öffnen des Fläschchens empfehlen wir, das Produkt mindestens 1 Stunde lang auf Raumtemperatur kommen zu lassen. Benötigen Sie weitere Ratschläge zur Löslichkeit, Verwendung und Handhabung? Besuchen Sie unsere Seite mit den häufig gestellten Fragen (FAQ) für weitere Informationen.

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 504751837
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751837
• Kanonisches Lächeln: CC(=O)OC1=C(C=CC(=C1)C(F)(F)F)C(=O)O
• IUPAC Name: 2-acetyloxy-4-(trifluoromethyl)benzoic acid
• InChIKey: RMWVZGDJPAKBDE-UHFFFAOYSA-N
• INCHI: 1S/C10H7F3O4/c1-5(14)17-8-4-6(10(11,12)13)2-3-7(8)9(15)16/h2-4H,1H3,(H,15,16)
• Isomere SMILES: CC(=O)OC1=C(C=CC(=C1)C(F)(F)F)C(=O)O
• WGK Deutschland: 3
• RTECS: GP4250000
• PubChem CID: 9458
• Molekulargewicht: 248.16

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Benzoic acids and derivatives
        • Ebene5 Hydroxybenzoic acid derivatives
          • Ebene6 Salicylic acid and derivatives
            • Ebene7 Acylsalicylic acids and derivatives
              • Ebene8 Acylsalicylic acids

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Benzoic acids and derivatives
• Intermediate Tree Nodes: Hydroxybenzoic acid derivatives - Salicylic acid and derivatives - Acylsalicylic acids and derivatives
• Direct Parent: Acylsalicylic acids
• Alternative Parents: Trifluoromethylbenzenes Phenol esters Benzoic acids Phenoxy compounds Benzoyl derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Carboxylic acids Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Acylsalicylic acid - Trifluoromethylbenzene - Phenol ester - Benzoic acid - Phenoxy compound - Benzoyl - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Carboxylic acid - Alkyl fluoride - Organohalogen compound - Organofluoride - Organooxygen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Alkyl halide - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as acylsalicylic acids. These are o-acylated derivatives of salicylic acid.
• 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

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rep Replicase polyprotein 1ab (378 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: DMSO 50 mg/mL Water <1 mg/mL Ethanol 50 mg/mL
• Empfindlichkeit: Heat Sensitive
• Schmelzpunkt (°C): 115 °C
• Molekulargewicht: 248.150 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 248.03 Da
• Monoisotopic Mass: 248.03 Da
• Topological Polar Surface Area: 63.600 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 313.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C. Freezer storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 322-79-2, the molecular formula is C10H7F3O4, and the molecular weight is 248.16 g/mol. InChIKey RMWVZGDJPAKBDE-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.