2-Iodothiophene - ≥97%, stabilized with copper , CAS No.3437-95-4

CAS: 3437-95-4 Cat. No.: I107041 Peso molecular: 210.04 Beilstein Registry Number: 104666 Número EC: 222-342-1

GRADE & PURITY ≥97%, stabilized with copper

Synonyms

2-Thienyl iodide

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

2-Thienyl iodide

Especificaciones y pureza

≥97%, stabilized with copper

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 504752913
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504752913
• Sonrisas canónicas: C1=CSC(=C1)I
• IUPAC Name: 2-iodothiophene
• InChIKey: ROIMNSWDOJCBFR-UHFFFAOYSA-N
• INCHI: 1S/C4H3IS/c5-4-2-1-3-6-4/h1-3H
• Isómeros SMILES: C1=CSC(=C1)I
• WGK Alemania: 3
• Peso molecular: 210.04
• Beilstein: 104666
• Reaxy-Rn: 104666
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=104666&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Aryl halides
      • Subclass Aryl iodides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Aryl halides
• Subclass: Aryl iodides
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl iodides
• Alternative Parents: Thiophenes Heteroaromatic compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl iodide - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Hydrocarbon derivative - Organoiodide - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as aryl iodides. These are organic compounds containing the acyl iodide functional 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

Propiedades químicas y físicas

• Sensibilidad: light sensitive ；Moisture sensitive
• Índice de refracción: 1.651-1.653
• Punto de inflamación (°F): 170.6 °F
• Punto de inflamación (°C): 71 °C
• Punto de ebullición (°C): 73°C
• Punto de fusión (°C): -40°C
• Peso molecular: 210.040 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 209.9 Da
• Monoisotopic Mass: 209.9 Da
• Topological Polar Surface Area: 28.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 46.800
• 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. Kan Zhan, Huanhuan You, Wenyu Liu, Jie Lu, Ping Lu, Jian Dong.  (2011)  Pd nanoparticles encaged in nanoporous interpenetrating polymer networks: A robust recyclable catalyst for Heck reactions.  REACTIVE & FUNCTIONAL POLYMERS,      [PMID:] [10.1016/j.reactfunctpolym.2011.04.007]