Pralidoxime Iodide - ≥98% , CAS No.94-63-3

CAS: 94-63-3 Cat. No.: P413227 Fórmula: C₇H₉IN₂O Peso molecular: 264.06 Número EC: 202-349-6

GRADE & PURITY ≥98%

Synonyms

(6S,7S,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid | pralidoxime iodide | BSPBio_001000 | GS 1043 | Pralidossima joduro | 2-[(E)-(hydroxyimino)methyl]-1-methylpyri

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

Information

Pralidoxime Iodide Pralidoxime Iodide (2-PAM) is an antidote approved for reactivation of inhibited acetylcholinesterase (AChE) in organophosphate poisoning.

Specifications

Sinónimos

(6S,7S,E)-3-(acetoxymethyl)-7-(2-(2-aminothiazol-4-yl)-2-(methoxyimino)acetamido)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid | pralidoxime iodide | BSPBio_001000 | GS 1043 | Pralidossima joduro | 2-[(E)-(hydroxyimino)methyl]-1-methylpyri

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

Pralidoxime Iodide (2-PAM) is an antidote approved for reactivation of inhibited acetylcholinesterase (AChE) in organophosphate poisoning.

Condiciones de almacenamiento de almacenamiento

Protected from light,Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488202858
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488202858
• Sonrisas canónicas: C[N+]1=CC=CC=C1C=NO.[I-]
• IUPAC Name: (NE)-N-[(1-methylpyridin-1-ium-2-yl)methylidene]hydroxylamine;iodide
• InChIKey: QNBVYCDYFJUNLO-UHFFFAOYSA-N
• INCHI: 1S/C7H8N2O.HI/c1-9-5-3-2-4-7(9)6-8-10;/h2-6H,1H3;1H
• Isómeros SMILES: C[N+]1=CC=CC=C1/C=N/O.[I-]
• Peso molecular: 264.06

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyridines and derivatives
      • Subclass Hydropyridines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Hydropyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: Dihydropyridines
• Alternative Parents: Trialkylamines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Enamines Azacyclic compounds Aminoxides Allylamines Organopnictogen compounds Organic oxides Organic iodide salts Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Dihydropyridine - Tertiary amine - Tertiary aliphatic amine - Enamine - Organic oxoazanium - Allylamine - Azacycle - Aminoxide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Amine - Organic salt - Organic iodide salt - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dihydropyridines. These are compounds containing a dihydropyridine moiety, which is a semi-saturated pyridine derivative with two double bonds.
• External Descriptors: pyridinium salt - organic iodide salt

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

Propiedades químicas y físicas

• Solubilidad: Solubility (25°C) In vitro DMSO: 52 mg/mL (196.92 mM)
• Sensibilidad: light sensitive；Moisture sensitive
• Punto de fusión (°C): ca 225° dec.
• Peso molecular: 264.060 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 263.976 Da
• Monoisotopic Mass: 263.976 Da
• Topological Polar Surface Area: 36.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 125.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Jian Zhang, Yibing Li, Ting Zhang, Zhihong Zheng, Hui Jing, Chunye Liu.  (2023)  Improving pesticide residue detection: Immobilized enzyme microreactor embedded in microfluidic paper-based analytical devices.  FOOD CHEMISTRY,      [PMID:38091789] [10.1016/j.foodchem.2023.138179]

2. Linghao He, Bingbing Cui, Jiameng Liu, Yingpan Song, Minghua Wang, Donglai Peng, Zhihong Zhang.  (2017)  Novel electrochemical biosensor based on core-shell nanostructured composite of hollow carbon spheres and polyaniline for sensitively detecting malathion.  SENSORS AND ACTUATORS B-CHEMICAL,      [PMID:] [10.1016/j.snb.2017.11.161]

3. Jing Dong, Juying Hou, Jianxia Jiang, Shiyun Ai.  (2015)  Innovative approach for the electrochemical detection of non-electroactive organophosphorus pesticides using oxime as electroactive probe.  ANALYTICA CHIMICA ACTA,      [PMID:26231893] [10.1016/j.aca.2015.05.033]