Perfluoro(methylcyclohexane) - ≥98% , CAS No.355-02-2

CAS: 355-02-2 Cat. No.: P407437 Formula: C₆F₁₁CF₃ Peso molecolare: 350.05 Beilstein Registry Number: 1915980 Numero EC: 206-573-5 PubChem CID: 9637

GRADE & PURITY ≥98%

Synonyms

Cyclohexane, undecafluoro(trifluoromethyl)- | FLUTEC PC 2 | DTXSID5059874 | Cyclohexane,2,2,3,3,4,4,5,5,6,6-undecafluoro- | Q17074544 | UNII-VJ9772YW63 | NSC-4779 | SCHEMBL37587 | Flutec PP2 | Undecafluoro(trifluoromethyl)cyclohexane | A822838 | Perfluoro

Storage

Room temperature,Desiccated

Shipped In

Normal

Panoramica

Perfluoro(methylcyclohexane) can be used as:
A reactant to synthesize perfluoro-2-methylcyclohex-1-enolate by photochemical reaction with tetrabutylammonium iodide in water.
A fluorous solvent to synthesize polynorbornene via ring-opening metathesis polymerization (ROMP) of norbornene using fluorous Grubbs′ second-generation catalyst.
It can also be used as a solvent to investigate fluorophilicity of a series of hydrocarbon and fluorocarbon-functionalized nicotinic acid esters.

Specifications

Sinonimi

Cyclohexane, undecafluoro(trifluoromethyl)- | FLUTEC PC 2 | DTXSID5059874 | Cyclohexane,2,2,3,3,4,4,5,5,6,6-undecafluoro- | Q17074544 | UNII-VJ9772YW63 | NSC-4779 | SCHEMBL37587 | Flutec PP2 | Undecafluoro(trifluoromethyl)cyclohexane | A822838 | Perfluoro

Specifiche e purezza

≥98%

Condizioni di conservazione di stoccaggio

Room temperature,Desiccated

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 504751854
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751854
• Sorrisi canonici: C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F
• IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6-undecafluoro-6-(trifluoromethyl)cyclohexane
• InChIKey: QIROQPWSJUXOJC-UHFFFAOYSA-N
• INCHI: 1S/C7F14/c8-1(7(19,20)21)2(9,10)4(13,14)6(17,18)5(15,16)3(1,11)12
• Isomeri SMILES: C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F
• WGK Germania: 3
• PubChem CID: 9637
• Peso molecolare: 350.05
• Beilstein: 1915980

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Alkyl halides
• Subclass: Cyclohexyl halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexyl halides
• Alternative Parents: Organofluorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexyl halide - Hydrocarbon derivative - Organofluoride - Alkyl fluoride - Aliphatic homomonocyclic compound
• Descrizione: 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

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.285
• Punto di ebollizione (°C): 76 °C
• Peso molecolare: 350.050 g/mol
• XLogP3: 4.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 0
• Exact Mass: 349.978 Da
• Monoisotopic Mass: 349.978 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 21
• Formal Charge: 0
• Complexity: 411.000
• 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

Riferimenti

1. Minghui Sun, Muthu Murugananthan, Zhiming Zhou, Yan Shen, Yanrong Zhang, Xiaoguang Wang.  (2024)  Hydrophobic covalent organic frameworks utilized Fluorocarbon/Water system for efficient hydrogen peroxide photosynthesis.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2024.150245]