4-Iodophenylsulfur pentafluoride - ≥98% , CAS No.286947-68-0

CAS: 286947-68-0 Cat. No.: I157643 Summenformel: C₆H₄F₅IS Molekulargewicht: 330.05 EG-Nummer: 678-569-5

GRADE & PURITY ≥98%

Synonyms

SCHEMBL472361 | 4-Iodophenylsulfur Pentafluoride | 1-Iodo-4-(pentafluorothio)benzene | 1-Iodo-4-(pentafluorosulfanyl)benzene | Sulfur, pentafluoro(4-iodophenyl)-, (OC-6-21)- | 1-iodo-4-pentafluorosulfanyl-benzene | T72228 | PS-11537 | STL557700 | DTXSID50

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

SCHEMBL472361 | 4-Iodophenylsulfur Pentafluoride | 1-Iodo-4-(pentafluorothio)benzene | 1-Iodo-4-(pentafluorosulfanyl)benzene | Sulfur, pentafluoro(4-iodophenyl)-, (OC-6-21)- | 1-iodo-4-pentafluorosulfanyl-benzene | T72228 | PS-11537 | STL557700 | DTXSID50

Spezifikationen & Reinheit

≥98%

Storage

Store at 2-8°C,Protected from light,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥98%

Namen und Kennungen

Kanonisches Lächeln

C1=CC(=CC=C1S(F)(F)(F)(F)F)I

IUPAC Name

pentafluoro-(4-iodophenyl)-λ6-sulfane

InChIKey

FRYANWYSCROOCU-UHFFFAOYSA-N

INCHI

1S/C6H4F5IS/c7-13(8,9,10,11)6-3-1-5(12)2-4-6/h1-4H

Isomere SMILES

C1=CC(=CC=C1S(F)(F)(F)(F)F)I

Molekulargewicht

330.05

Reaxy-Rn

8547644

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8547644&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives
      • Subclass Halobenzenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Iodobenzenes
• Alternative Parents: Aryl iodides Organosulfur compounds Organoiodides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Iodobenzene - Aryl iodide - Aryl halide - Hydrocarbon derivative - Organosulfur compound - Organoiodide - Organohalogen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as iodobenzenes. These are aromatic compounds containing one or more iodine atoms attached to a benzene.
• 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in Toluene
• Empfindlichkeit: Air Sensitive,Heat Sensitive
• Siedepunkt (°C): 52°C/0.8mmHg
• Schmelzpunkt (°C): 36 °C
• Molekulargewicht: 330.060 g/mol
• XLogP3: 6.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 329.9 Da
• Monoisotopic Mass: 329.9 Da
• Topological Polar Surface Area: 1.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 200.000
• 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 ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. 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 286947-68-0, the molecular formula is C6H4F5IS, and the molecular weight is 330.05 g/mol. InChIKey FRYANWYSCROOCU-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.