Lithium trifluoromethanesulfonate - ≥98% , CAS No.33454-82-9

CAS: 33454-82-9 Cat. No.: L101046 Molecular Weight: 156.01 Beilstein Registry Number: 4301818 EC Number: 251-528-5

GRADE & PURITY ≥98%

Synonyms

LiTf | Lithium trifluoromethanesulfonate, Trace metals grade, 99.95% | LiTf | LiTFS | lithium(1+) ion trifluoromethanesulfonate | AMY3638 | NSC 175813 | EINECS 251-528-5 | Lithiumtrifluoromethanesulfonate (LiTFS) | lithium trifluoromethane sulfonate salt

Storage

Room temperature,Argon charged

Shipped In

Normal

Overview

Lithium trifluoromethanesulfonate is a class of electrolytic materials that can be used in the fabrication of lithium-ion batteries. Lithium-ion batteries consist of anode, cathode, and electrolyte with a charge-discharge cycle. These materials enable the formation of greener and sustainable batteries for electrical energy storage.

Specifications

Synonyms

LiTf | Lithium trifluoromethanesulfonate, Trace metals grade, 99.95% | LiTf | LiTFS | lithium(1+) ion trifluoromethanesulfonate | AMY3638 | NSC 175813 | EINECS 251-528-5 | Lithiumtrifluoromethanesulfonate (LiTFS) | lithium trifluoromethane sulfonate salt

Specifications & Purity

≥98%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Canonical Smiles: [Li+].C(F)(F)(F)S(=O)(=O)[O-]
• IUPAC Name: lithium;trifluoromethanesulfonate
• InChIKey: MCVFFRWZNYZUIJ-UHFFFAOYSA-M
• INCHI: 1S/CHF3O3S.Li/c2-1(3,4)8(5,6)7;/h(H,5,6,7);/q;+1/p-1
• Isomeric SMILES: [Li+].C(F)(F)(F)S(=O)(=O)[O-]
• WGK Germany: 3
• Molecular Weight: 156.01
• Beilstein: 4301818
• Reaxy-Rn: 4301818
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4301818&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Class Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives
        • Level5 Alkanesulfonic acids and derivatives
          • Level6 Alkanesulfonic acids
            • Level7 Trifluoromethanesulfonates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Class: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Alkanesulfonic acids and derivatives - Alkanesulfonic acids
• Direct Parent: Trifluoromethanesulfonates
• Alternative Parents: Sulfonyls Organosulfonic acids Methanesulfonates Trihalomethanes Organic metal halides Organic lithium salts Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trifluoromethanesulfonate - Methanesulfonate - Organosulfonic acid - Sulfonyl - Trihalomethane - Organic metal halide - Organic lithium salt - Organic alkali metal salt - Alkyl fluoride - Hydrocarbon derivative - Organic salt - Halomethane - Organic oxide - Organosulfur compound - Organofluoride - Organohalogen compound - Organic oxygen compound - Alkyl halide - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trifluoromethanesulfonates. These are alkanesulfonic acids, that contain a sulfonate group that is substituted with a trifluoromethyl group.
• 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

• Solubility: Miscible with water.
• Sensitivity: Moisture sensitive.
• Melt Point(°C): >300°C
• Molecular Weight: 156.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 0
• Exact Mass: 155.968 Da
• Monoisotopic Mass: 155.968 Da
• Topological Polar Surface Area: 65.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 162.000
• 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

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