2-Iodopyridine - ≥97%, stabilized with copper , CAS No.5029-67-4

CAS: 5029-67-4 Cat. No.: I111393 Peso molecular: 205.00 Número EC: 610-520-5

GRADE & PURITY ≥97%, stabilized with copper

Synonyms

CCZWSTFVHJPCEM-UHFFFAOYSA-N | EN300-88338 | NoName_4580 | SY013861 | 2-pyridyl iodide | DTXSID60903821 | STL557827 | 2-Iodopyridine, 98% | AC-5807 | AM81300 | Pyridine, iodo- | FT-0645304 | J-509734 | I0533 | A7464 | BP-10744 | AKOS015853921 | MFCD0046492

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

CCZWSTFVHJPCEM-UHFFFAOYSA-N | EN300-88338 | NoName_4580 | SY013861 | 2-pyridyl iodide | DTXSID60903821 | STL557827 | 2-Iodopyridine, 98% | AC-5807 | AM81300 | Pyridine, iodo- | FT-0645304 | J-509734 | I0533 | A7464 | BP-10744 | AKOS015853921 | MFCD0046492

Especificaciones y pureza

≥97%, stabilized with copper

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504757900
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504757900
• Sonrisas canónicas: C1=CC=NC(=C1)I
• IUPAC Name: 2-iodopyridine
• InChIKey: CCZWSTFVHJPCEM-UHFFFAOYSA-N
• INCHI: 1S/C5H4IN/c6-5-3-1-2-4-7-5/h1-4H
• Isómeros SMILES: C1=CC=NC(=C1)I
• WGK Alemania: 3
• Peso molecular: 205.00
• Reaxy-Rn: 105790
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=105790&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyridines and derivatives
• Subclass: Halopyridines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-halopyridines
• Alternative Parents: Aryl iodides Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-halopyridine - Aryl iodide - Aryl halide - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Organoiodide - Organohalogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as 2-halopyridines. These are organic compounds containing a pyridine ring substituted at the 2-position by a halogen atom.
• 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

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: Slightly soluble in water.
• Sensibilidad: Air sensitive; Light sensitive
• Índice de refracción: 1.632
• Punto de inflamación (°C): 84 °C
• Punto de ebullición (°C): 52 °C
• Peso molecular: 205.000 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 204.939 Da
• Monoisotopic Mass: 204.939 Da
• Topological Polar Surface Area: 12.900 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 56.000
• 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

Referencias

1. Ying Chen, Lei Tian, Wen Liu, Yi Mei, Qiu-Ju Xing, Yi Mu, Ling-Ling Zheng, Qian Fu, Jian-Ping Zou, Daishe Wu.  (2024)  Controllable Pyridine N-Oxidation–Nucleophilic Dechlorination Process for Enhanced Dechlorination of Chloropyridines: The Cooperation of HCO4– and HO2–.  ENVIRONMENTAL SCIENCE & TECHNOLOGY,      [PMID:38330552] [10.1021/acs.est.3c09878]