S 24795 - ≥98% , CAS No.304679-75-2

CAS: 304679-75-2 Cat. No.: S287505 Formule: C₁₄H₁₃BrINO Poids moléculaire: 418.07 Numéro CE: 808-959-4 PubChem CID: 9888248

GRADE & PURITY ≥98%

Synonyms

S 24795 | HY-11053 | S 24795, >=98% (HPLC) | 2-[2-(4-bromophenyl)-2-oxoethyl]-1-methylpyridiniumiodide | 2-[2-(4-Bromophenyl)-2-oxoethyl]-1-methylpyridinium iodide | AKOS024457657 | s-24795 | 1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Specifications

Synonymes

S 24795 | HY-11053 | S 24795, >=98% (HPLC) | 2-[2-(4-bromophenyl)-2-oxoethyl]-1-methylpyridiniumiodide | 2-[2-(4-Bromophenyl)-2-oxoethyl]-1-methylpyridinium iodide | AKOS024457657 | s-24795 | 1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide

Spécifications et pureté

≥98%

Mécanismes biochimiques et physiologiques

Partial agonist ofα7 nAChR. Improves mnemonic function in aged mice for the treatment of aging-related memory disturbances. Displays more efficient memory-enhancing effects thanmemantine in Alzheimer's disease mouse models.

Conditions de stockage de stockage

Protected from light,Store at -20°C

Expédié en

Ice chest + Ice pads

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥98%

Noms et identifiants

Pubchem Sid

528766982

Sourires canoniques

C[N+]1=CC=CC=C1CC(=O)C2=CC=C(C=C2)Br.[I-]

IUPAC Name

1-(4-bromophenyl)-2-(1-methylpyridin-1-ium-2-yl)ethanone;iodide

InChIKey

LERUHBBUGAOYOD-UHFFFAOYSA-M

INCHI

1S/C14H13BrNO.HI/c1-16-9-3-2-4-13(16)10-14(17)11-5-7-12(15)8-6-11;/h2-9H,10H2,1H3;1H/q+1;/p-1

Isomères SMILES

C[N+]1=CC=CC=C1CC(=O)C2=CC=C(C=C2)Br.[I-]

PubChem CID

9888248

Poids moléculaire

418.07

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbonyl compounds
        • Level5 Ketones
          • Level6 Aryl ketones
            • Level7 Phenylketones
              • Level8 Alkyl-phenylketones

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbonyl compounds
• Intermediate Tree Nodes: Ketones - Aryl ketones - Phenylketones
• Direct Parent: Alkyl-phenylketones
• Alternative Parents: Benzoyl derivatives Aryl alkyl ketones N-methylpyridinium compounds Bromobenzenes Pyridinium derivatives Aryl bromides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Organic iodide salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - N-methylpyridinium - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Benzenoid - Pyridinium - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic iodide salt - Hydrocarbon derivative - Organic oxide - Organic salt - Organic cation - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
• 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

Propriétés chimiques et physiques

• Solubilité: Solvent:water, Max Conc. mg/mL: 4.18, Max Conc. mM: 10 with gentle warming; Solvent:DMSO, Max Conc. mg/mL: 41.81, Max Conc. mM: 100
• Sensibilité: light sensitive
• Poids moléculaire: 418.070 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 416.923 Da
• Monoisotopic Mass: 416.923 Da
• Topological Polar Surface Area: 21.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 261.000
• 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: 2

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