Undecafluoroiodocyclohexane (stabilized with Copper chip) - ≥98%(GC) , CAS No.355-69-1

CAS: 355-69-1 Cat. No.: U162897 Peso molecular: 407.95 Beilstein Registry Number: 5(4)79 Número EC: 671-778-2 PubChem CID: 2759367

GRADE & PURITY ≥98%(GC)

Synonyms

BBL102974 | AKOS005254333 | D92775 | SCHEMBL289557 | MFCD00156095 | U0080 | DTXSID70374765 | Perfluorocyclohexyl iodide | undecafluoro(iodo)cyclohexane | STL556783 | 1-Iodoundecafluorocyclohexane | AS-81615 | Undecafluoroiodocyclohexane | 1,1,2,2,3,3,4,4,

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

BBL102974 | AKOS005254333 | D92775 | SCHEMBL289557 | MFCD00156095 | U0080 | DTXSID70374765 | Perfluorocyclohexyl iodide | undecafluoro(iodo)cyclohexane | STL556783 | 1-Iodoundecafluorocyclohexane | AS-81615 | Undecafluoroiodocyclohexane | 1, 1, 2, 2, 3, 3, 4, 4,

Especificaciones y pureza

≥98%(GC)

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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Pureza

≥98%(GC)

Nombres e identificadores

• Pubchem Sid: 504761555
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761555
• Sonrisas canónicas: C1(C(C(C(C(C1(F)F)(F)F)(F)I)(F)F)(F)F)(F)F
• IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-iodocyclohexane
• InChIKey: WYRAAMGCHCLHRD-UHFFFAOYSA-N
• INCHI: 1S/C6F11I/c7-1(8)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12
• Isómeros SMILES: C1(C(C(C(C(C1(F)F)(F)F)(F)I)(F)F)(F)F)(F)F
• PubChem CID: 2759367
• Peso molecular: 407.95
• Beilstein: 5(4)79
• Reaxy-Rn: 2283554

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Alkyl halides
      • Subclass Cyclohexyl halides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Alkyl halides
• Subclass: Cyclohexyl halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexyl halides
• Alternative Parents: Organoiodides Organofluorides Hydrocarbon derivatives Alkyl iodides Alkyl fluorides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexyl halide - Hydrocarbon derivative - Organoiodide - Organofluoride - Alkyl iodide - Alkyl fluoride - Aliphatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as cyclohexyl halides. These are organohalogen compounds containing a monocyclic cyclohexane moiety that is substituted at one or more positions by an 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

Propiedades químicas y físicas

• Índice de refracción: 1.36
• Punto de ebullición (°C): 112°C(lit.)
• Peso molecular: 407.950 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 0
• Exact Mass: 407.887 Da
• Monoisotopic Mass: 407.887 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 342.000
• 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