1-dodecyl-3-methylimidazolium chloride - ≥99% , CAS No.114569-84-5

CAS: 114569-84-5 Cat. No.: D188991 Peso molecular: 286.88 Número EC: 801-405-2

GRADE & PURITY ≥99%

Synonyms

MFCD03427606 | DTXSID9047918 | NCGC00258149-01 | 1-dodecyl-3-methylimidazol-3-ium;chloride | ZB1676 | Tox21_200595 | 1-DODECYL-3-METHYLIMIDAZOLIUMCHLORIDE | D5352 | 1-dodecyl-3-methyl-1H-imidazol-3-ium chloride | 1H-Imidazolium, 1-dodecyl-3-methyl-, chlor

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

MFCD03427606 | DTXSID9047918 | NCGC00258149-01 | 1-dodecyl-3-methylimidazol-3-ium;chloride | ZB1676 | Tox21_200595 | 1-DODECYL-3-METHYLIMIDAZOLIUMCHLORIDE | D5352 | 1-dodecyl-3-methyl-1H-imidazol-3-ium chloride | 1H-Imidazolium, 1-dodecyl-3-methyl-, chlor

Especificaciones y pureza

≥99%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥99%

Nombres e identificadores

• Pubchem Sid: 488192509
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192509
• Sonrisas canónicas: CCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
• IUPAC Name: 1-dodecyl-3-methylimidazol-3-ium;chloride
• InChIKey: OPXNHKQUEXEWAM-UHFFFAOYSA-M
• INCHI: 1S/C16H31N2.ClH/c1-3-4-5-6-7-8-9-10-11-12-13-18-15-14-17(2)16-18;/h14-16H,3-13H2,1-2H3;1H/q+1;/p-1
• Isómeros SMILES: CCCCCCCCCCCCN1C=C[N+](=C1)C.[Cl-]
• Peso molecular: 286.88
• Reaxy-Rn: 7556966
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7556966&ln=

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 Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: N-substituted imidazole - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - 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

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pol Human immunodeficiency virus type 1 integrase (9041 Activities)

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Mecanismos de acción

Propiedades químicas y físicas

• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 46.0 to 50.0 °C
• Peso molecular: 286.900 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 286.218 Da
• Monoisotopic Mass: 286.218 Da
• Topological Polar Surface Area: 8.800 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 182.000
• 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

1. Han Jia, Peng Lian, Xu Leng, Yugui Han, Qiuxia Wang, Kaile Jia, Xinpeng Niu, Muzhi Guo, Hui Yan, Kaihe Lv.  (2019)  Mechanism studies on the application of the mixed cationic/anionic surfactant systems to enhance oil recovery.  FUEL,      [PMID:] [10.1016/j.fuel.2019.116156]

2. Si-Yu Chen, Hao-Fei Geng, Jia-Qiang Yang, Yi Zhao, Ren Hu, Jian-Jia Su, Yuan-Fei Wu, Fang-Zu Yang, Bin Ren, Lian-Huan Han, Dong-Ping Zhan.  (2025)  Potential- and Convection-Dependent Synergistic Coadsorption of Electroplating Additives for Vias Copper Interconnection Evidenced by Shell-Isolated Nanoparticle-Enhanced Raman Spectroscopy.  ANALYTICAL CHEMISTRY,      [PMID:40758700] [10.1021/acs.analchem.5c01577]