1-(2-Hydroxyethyl)-3-methylimidazolium Tetrafluoroborate - ≥98% , CAS No.374564-83-7

CAS: 374564-83-7 Cat. No.: H157306 Molecular Weight: 213.97 EC Number: 801-294-0

GRADE & PURITY ≥98%

Synonyms

ZPA56483 | 1-(2-hydroxyethyl)-3-methyl-1H-imidazol-3-ium; tetrafluoroboranuide | DTXSID0049286 | 1-(2 inverted exclamation mark -hydroxylethyl)-3-methylimidazolium tetrafluoroborate | 1-(2-Hydroxyethyl)-3-methyl-1H-imidazol-3-iumtetrafluoroborate | SCHEMB

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

ZPA56483 | 1-(2-hydroxyethyl)-3-methyl-1H-imidazol-3-ium; tetrafluoroboranuide | DTXSID0049286 | 1-(2 inverted exclamation mark -hydroxylethyl)-3-methylimidazolium tetrafluoroborate | 1-(2-Hydroxyethyl)-3-methyl-1H-imidazol-3-iumtetrafluoroborate | SCHEMB

Specifications & Purity

≥98%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488197418
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488197418
• Canonical Smiles: [B-](F)(F)(F)F.C[N+]1=CN(C=C1)CCO
• IUPAC Name: 2-(3-methylimidazol-3-ium-1-yl)ethanol;tetrafluoroborate
• InChIKey: KLTUZFZUYLXTFF-UHFFFAOYSA-N
• INCHI: 1S/C6H11N2O.BF4/c1-7-2-3-8(6-7)4-5-9;2-1(3,4)5/h2-3,6,9H,4-5H2,1H3;/q+1;-1
• Isomeric SMILES: [B-](F)(F)(F)F.C[N+]1=CN(C=C1)CCO
• Alternate CAS: 61755-32-6
• Molecular Weight: 213.97

Taxonomic Classification

Taxonomy Tree

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

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

Chemical and Physical Properties

• Sensitivity: Moisture sensitive.
• Refractive Index: 1.43
• Molecular Weight: 213.970 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 214.09 Da
• Monoisotopic Mass: 214.09 Da
• Topological Polar Surface Area: 29.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 106.000
• 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

References

1. Yucheng Pan, Min Sang, Junshuo Zhang, Zimu Li, Shuai Liu, Zhentao Zhang, Qian Ma, Xinglong Gong.  (2024)  An integrative warning-protection shear thickened composite sponge towards sensing performance and impact resistance with excellent flame retardant.  COMPOSITES PART B-ENGINEERING,      [PMID:] [10.1016/j.compositesb.2024.111466]

2. Yucheng Pan, Min Sang, Shilong Duan, Zimu Li, Zhentao Zhang, Shuai Liu, Jianpeng Wu, Hong Chen, Yuan Hu, Xinglong Gong.  (2025)  MXene Assisted Shear Thickening Fluids Reinforced Anti-Impact Composite Aerogel with Superior Electromagnetic Shielding and Flame Retardant Performance.  Small,      [PMID:40135349] [10.1002/smll.202500493]