1-Iodo-1H,1H,2H,2H-perfluorodecane - ≥98% , CAS No.2043-53-0

CAS: 2043-53-0 Cat. No.: I122275 Peso molecular: 574.02 Beilstein Registry Number: 1894667 Número EC: 218-053-5

GRADE & PURITY ≥98%

Synonyms

1H,1H,2H,2H-Perfluoro-1-iododecane | Benzenemethanaminium, N,N,N-trimethyl-, bromide | MS-20459 | 2-(perfluorooctyl)ethyl iodide | o-(Hydroxymethyl)aniline | 8:2 Fluorotelomer iodide | DTXSID6062123 | FT-0607941 | 1-(Perfluorooctyl)-2-iodoethane | C8F17CH

Storage

Protected from light,Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Descripción general

1-Iodo-1H,1H,2H,2H-perfluorodecane was identified as Persistent Organic Pollutant (POP) and was listed as high-production-volume chemical (HPVC).

1-Iodo-1H,1H,2H,2H-perfluorodecane may be used in the preparation of 2,2′-bipyridines featuring fluorinated alkyl groups.

Specifications

Sinónimos

1H, 1H, 2H, 2H-Perfluoro-1-iododecane | Benzenemethanaminium, N, N, N-trimethyl-, bromide | MS-20459 | 2-(perfluorooctyl)ethyl iodide | o-(Hydroxymethyl)aniline | 8:2 Fluorotelomer iodide | DTXSID6062123 | FT-0607941 | 1-(Perfluorooctyl)-2-iodoethane | C8F17CH

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged, Desiccated, Cool

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504754881
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754881
• Sonrisas canónicas: C(CI)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• IUPAC Name: 1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-heptadecafluoro-10-iododecane
• InChIKey: XVKJSLBVVRCOIT-UHFFFAOYSA-N
• INCHI: 1S/C10H4F17I/c11-3(12,1-2-28)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2
• Isómeros SMILES: C(CI)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
• WGK Alemania: 3
• Peso molecular: 574.02
• Beilstein: 1894667
• Reaxy-Rn: 1894667
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1894667&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Clase Organoiodides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Clase: Organoiodides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organoiodides
• Alternative Parents: Organofluorides Hydrocarbon derivatives Alkyl iodides Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organoiodide - Organofluoride - Alkyl iodide - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as organoiodides. These are compounds containing a chemical bond between a carbon atom and an iodine 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

• Solubilidad: Insoluble in water.
• Sensibilidad: Light Sensitive;Air sensitive
• Punto de ebullición (°C): 96°C/12mmHg
• Punto de fusión (°C): 58°C
• Peso molecular: 574.020 g/mol
• XLogP3: 7.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 17
• Rotatable Bond Count: 8
• Exact Mass: 573.909 Da
• Monoisotopic Mass: 573.909 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 28
• Formal Charge: 0
• Complexity: 559.000
• 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. Kaimei Peng, Jianqing Hu, Xuexin Dai, Zaibo Yang, Runping Wang, Weiping Tu.  (2019)  Development of self-stratified antibacterial polymers via click chemistry.  RSC Advances,  9  (23): (13159-13167).  [PMID:35520805] [10.1039/C9RA01572H]