4(5)-Ethylimidazole - ≥95%(GC) , CAS No.19141-85-6

CAS: 19141-85-6 Cat. No.: E156331 Fórmula: C₅H₈N₂ Peso molecular: 96.13 Número EC: 806-948-9

CALIDAD & PUREZA ≥95%(GC)

Synonyms

4-ethyl-1H-imidazole|4(5)-Ethylimidazole|1H-Imidazole, 4-ethyl-|5-ethylimidazole|4-Ethylimidazole|5-ethyl-1H-imidazole|1H-Imidazole, 5-ethyl-|5-ETHYLIMIDAZOL

Storage

Argon charged,Room temperature

Shipped In

Normal

Especificaciones

Sinónimos

4-ethyl-1H-imidazole | 4(5)-Ethylimidazole | 1H-Imidazole, 4-ethyl- | 5-ethylimidazole | 4-Ethylimidazole | 5-ethyl-1H-imidazole | 1H-Imidazole, 5-ethyl- | 5-ETHYLIMIDAZOL

Especificaciones y pureza

≥95%(GC)

Condiciones de almacenamiento de almacenamiento

Argon charged,Room temperature

Enviado en

Normal

Pureza

≥95%(GC)

Nombres e identificadores

Pubchem Sid

488196552

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488196552

Sonrisas canónicas

CCC1=CN=CN1

IUPAC Name

5-ethyl-1H-imidazole

InChIKey

NJQHZENQKNIRSY-UHFFFAOYSA-N

INCHI

1S/C5H8N2/c1-2-5-3-6-4-7-5/h3-4H,2H2,1H3,(H,6,7)

Isómeros SMILES

CCC1=CN=CN1

Peso molecular

96.13

Reaxy-Rn

741980

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=741980&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azoles
      • Subclass Imidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Imidazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Imidazole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as imidazoles. These are compounds containing an imidazole ring, which is an aromatic five-member ring with two nitrogen atoms at positions 1 and 3, and three carbon atoms.
• 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: Air sensitive
• Índice de refracción: 1.5
• Punto de inflamación (°C): 125℃
• Punto de ebullición (°C): 140℃/3mmHg(lit.)
• Peso molecular: 96.130 g/mol
• XLogP3: 0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 96.0687 Da
• Monoisotopic Mass: 96.0687 Da
• Topological Polar Surface Area: 28.700 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 54.000
• 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

Preguntas frecuentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥95% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 19141-85-6, the molecular formula is C5H8N2, and the molecular weight is 96.13 g/mol. InChIKey NJQHZENQKNIRSY-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.