1-Ethyl-3-methylimidazolium tetrafluoroborate (EMIMBF₄) - ≥98% , CAS No.143314-16-3

CAS: 143314-16-3 Cat. No.: E120493 Peso molecular: 197.97 Número EC: 671-177-5 PubChem CID: 2769348

GRADE & PURITY ≥98%

Synonyms

EMIMBF4

Storage

Room temperature,Argon charged

Shipped In

Normal

Descripción general

1-Ethyl-3-methylimidazolium tetrafluoroborate is a room temperature ionic liquid (RTIL).

Specifications

Sinónimos

EMIMBF4

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature, Argon charged

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488193405
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488193405
• Sonrisas canónicas: [B-](F)(F)(F)F.CCN1C=C[N+](=C1)C
• IUPAC Name: 1-ethyl-3-methylimidazol-3-ium;tetrafluoroborate
• InChIKey: CUNYTRQQXKCRTJ-UHFFFAOYSA-N
• INCHI: 1S/C6H11N2.BF4/c1-3-8-5-4-7(2)6-8;2-1(3,4)5/h4-6H,3H2,1-2H3;/q+1;-1
• Isómeros SMILES: [B-](F)(F)(F)F.CCN1C=C[N+](=C1)C
• WGK Alemania: 3
• PubChem CID: 2769348
• Número ONU: 3082
• Peso molecular: 197.97
• Reaxy-Rn: 5465671

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azoles
      • Subclass Imidazoles
        • Level5 Substituted imidazoles
          • Level6 N-substituted imidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Imidazoles
• Intermediate Tree Nodes: Substituted imidazoles
• Direct Parent: N-substituted imidazoles
• Alternative Parents: Heteroaromatic compounds Organic metalloid salts Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-substituted imidazole - Heteroaromatic compound - Azacycle - Organic metalloid salt - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as n-substituted imidazoles. These are heterocyclic compounds containing an imidazole ring substituted at position 1.
• 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

• Sensibilidad: Hygroscopic
• Índice de refracción: 1.41
• Punto de inflamación (°F): 235.4 °F
• Punto de inflamación (°C): 113 °C
• Punto de ebullición (°C): 350°C
• Punto de fusión (°C): 15°C
• Peso molecular: 197.970 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 198.095 Da
• Monoisotopic Mass: 198.095 Da
• Topological Polar Surface Area: 8.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 92.000
• 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: 2

XLogP3

Referencias

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