Ethyl Nonafluorobutyl Ether (mixture of isomers) - ≥98% , CAS No.813458-04-7

CAS: 813458-04-7 Cat. No.: E156086 Peso molecular: 264.09 Número EC: 828-053-2

GRADE & PURITY ≥98%

Synonyms

PHENOL, P-(2-(DIMETHYLAMINO)ETHYL)- | (perfluorobutoxy)ethane | HFE-569sf2 (7200) | AS-75548 | UNII-520BW6FQ5U | 1-ethoxy-nonafluorobutane | FT-0676097 | NOVEC HFE 7200 | Ethyl Nonafluorobutyl Ether (mixture of isomers) | Butane, 1-ethoxy-1,1,2,2,3,3,4,4,

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

PHENOL, P-(2-(DIMETHYLAMINO)ETHYL)- | (perfluorobutoxy)ethane | HFE-569sf2 (7200) | AS-75548 | UNII-520BW6FQ5U | 1-ethoxy-nonafluorobutane | FT-0676097 | NOVEC HFE 7200 | Ethyl Nonafluorobutyl Ether (mixture of isomers) | Butane, 1-ethoxy-1, 1, 2, 2, 3, 3, 4, 4,

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488188620
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488188620
• Sonrisas canónicas: CCOC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
• IUPAC Name: 1-ethoxy-1,1,2,2,3,3,4,4,4-nonafluorobutane
• InChIKey: DFUYAWQUODQGFF-UHFFFAOYSA-N
• INCHI: 1S/C6H5F9O/c1-2-16-6(14,15)4(9,10)3(7,8)5(11,12)13/h2H2,1H3
• Isómeros SMILES: CCOC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
• CAS alternativo: 163702-06-5
• Peso molecular: 264.09
• Reaxy-Rn: 8206697
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=8206697&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Organofluorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• 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
• Índice de refracción: 1.28
• Punto de ebullición (°C): 76°C
• Punto de fusión (°C): -138 °C
• Peso molecular: 264.090 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 4
• Exact Mass: 264.02 Da
• Monoisotopic Mass: 264.02 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 243.000
• 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. Huang Jiawen, An Xingguo, Cheng Zhongling, Li Laiquan, Dou Shi-Xue, Liu Hua-Kun, Wu Chao.  (2025)  Dipole-dipole interaction-induced dense primitive solid-electrolyte interphase for high-power Ah-level anode-free sodium metal batteries.  Nature Communications,  16  (1): (1-16).  [PMID:41022750] [10.1038/s41467-025-63593-x]