1-(2-Hydroxyethyl)imidazole - ≥97% , CAS No.1615-14-1

CAS: 1615-14-1 Cat. No.: H140402 Formula: C₅H₈N₂O Peso molecolare: 112.13 Numero EC: 216-565-3

GRADE & PURITY ≥97%

Synonyms

1-(2-HYDROXYETHYL)-1H-IMIDAZOLE | 1H-Imidazole-1-ethanol | DTXSID3058616 | SCHEMBL11788 | EC-000.1376 | 0462U14DUI | 1H-imidazole -1-ethanol | 1-(2-hydroxyethylimidazole | 1-(2-Hydroxyethyl)imidazole | imidazole-1-ethanol | 2-(1H-imidazol-1-yl)ethan-1-ol

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinonimi

1-(2-HYDROXYETHYL)-1H-IMIDAZOLE | 1H-Imidazole-1-ethanol | DTXSID3058616 | SCHEMBL11788 | EC-000.1376 | 0462U14DUI | 1H-imidazole -1-ethanol | 1-(2-hydroxyethylimidazole | 1-(2-Hydroxyethyl)imidazole | imidazole-1-ethanol | 2-(1H-imidazol-1-yl)ethan-1-ol

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged

Spedito in

Normal

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

504754777

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754777

Sorrisi canonici

C1=CN(C=N1)CCO

IUPAC Name

2-imidazol-1-ylethanol

InChIKey

AMSDWLOANMAILF-UHFFFAOYSA-N

INCHI

1S/C5H8N2O/c8-4-3-7-2-1-6-5-7/h1-2,5,8H,3-4H2

Isomeri SMILES

C1=CN(C=N1)CCO

WGK Germania

3

Peso molecolare

112.13

Reaxy-Rn

109881

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109881&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azoles
• Subclass: Imidazoles
• Intermediate Tree Nodes: Substituted imidazoles
• Direct Parent: N-substituted imidazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Alkanolamines Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-substituted imidazole - Heteroaromatic compound - Azacycle - Alkanolamine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Aromatic heteromonocyclic compound
• Descrizione: 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Indice di rifrazione: 1.55
• Punto di infiammabilità (°F): >230 °F
• Punto di infiammabilità (°C): >110 °C
• Punto di ebollizione (°C): 316.49 °C
• Punto di fusione (°C): 36-40°C
• Peso molecolare: 112.130 g/mol
• XLogP3: -0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 112.064 Da
• Monoisotopic Mass: 112.064 Da
• Topological Polar Surface Area: 38.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 67.400
• 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