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

CAS: 19141-85-6 Cat. No.: E156331 分子式: C₅H₈N₂ 分子量: 96.13 EC番号: 806-948-9

グレード＆純度 ≥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

仕様

同義語

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

仕様と純度

≥95%(GC)

保管条件

Argon charged,Room temperature

入荷

Normal

純度

≥95%(GC)

名前と識別子

パブケム・シド

488196552

パブケム・シド・ウル

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

カノニカル・スマイル

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)

異性体SMILES

CCC1=CN=CN1

分子量

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
    • 分類 Azoles
      • Subclass Imidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: 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
• 説明: 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

化学的性質と物理的性質

• 感度: Air sensitive
• 屈折率: 1.5
• 引火点（°C）: 125℃
• 沸点（°C）: 140℃/3mmHg(lit.)
• 分子量: 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

よくある質問

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.