Lithium chloride - ≥99.9% metals basis , CAS No.7447-41-8

CAS: 7447-41-8 Cat. No.: L573372 Formula: LiCl Molecular Weight: 42.39 EC Number: 231-212-3

GRADE & PURITY ≥99.9% metals basis

Synonyms

CCRIS 5924 | HSDB 4281 | Lithium chloride, puriss. p.a., ACS reagent, anhydrous, >=99.0% (AT) | NCGC00093980-01 | (2R)-2-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-3-naphthalen-2-ylpropanoic acid | (S)-N-(9-FLUORENYLMETHOXYCARBONYL)-2-AMINO-4-PENTYNOIC ACI

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Overview

Lithium chloride can be used as:

The source of chloride anions, used to convert alcohols into alkyl chlorides under photochemical conditions.

Additives in palladium-catalyzed coupling and carbonylation coupling reactions of organosilanes and trifluoroethylene esters.

Reagent for the cleavage of protecting groups under mild conditions. It readily converts acetal and ketone compounds into the corresponding carbonyl compounds.

In the DMF environment, the reagent for dehydrohalogenating α-halocarbonyl compounds into α,β-unsaturated carbonyl compounds.

LiCl can also be used in combination with other reagents:

LiCl:DIPEA (1:1 molar ratio) is used in the Horeau–Worsham–Emmons alkylation reaction.

Trimethylphosphine oxide is used in decarboxylative alkylation and chloride ion displacement reactions.

LiCl is used as an additive in solid-phase peptide synthesis because it increases resin expansion and improves the efficiency of complex coupling steps.

Specifications

Synonyms

CCRIS 5924 | HSDB 4281 | Lithium chloride, puriss. p.a., ACS reagent, anhydrous, >=99.0% (AT) | NCGC00093980-01 | (2R)-2-({[(1,1-dimethylethyl)oxy]carbonyl}amino)-3-naphthalen-2-ylpropanoic acid | (S)-N-(9-FLUORENYLMETHOXYCARBONYL)-2-AMINO-4-PENTYNOIC ACI

Specifications & Purity

≥99.9% metals basis

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Purity

≥99.9% metals basis

Names and Identifiers

• Canonical Smiles: [Li+].[Cl-]
• IUPAC Name: lithium;chloride
• InChIKey: KWGKDLIKAYFUFQ-UHFFFAOYSA-M
• INCHI: 1S/ClH.Li/h1H;/q;+1/p-1
• Isomeric SMILES: [Li+].[Cl-]
• WGK Germany: 3
• RTECS: OJ5950000
• Molecular Weight: 42.39

Taxonomic Classification

Taxonomy Tree

• Kingdom Inorganic compounds
  • Superclass Mixed metal/non-metal compounds
    • Class Alkali metal salts
      • Subclass Alkali metal chlorides

• Kingdom: Inorganic compounds
• Superclass: Mixed metal/non-metal compounds
• Class: Alkali metal salts
• Subclass: Alkali metal chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkali metal chlorides
• Alternative Parents: Inorganic lithium salts Inorganic chloride salts
• Molecular Framework: Not available
• Substituents: Alkali metal chloride - Inorganic lithium salt - Inorganic chloride salt - Inorganic salt
• Description: This compound belongs to the class of inorganic compounds known as alkali metal chlorides. These are inorganic compounds in which the largest halogen atom is Chlorine, and the heaviest metal atom is an alkali metal.
• External Descriptors: inorganic chloride - lithium salt

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

Associated Targets(Human)

CHRM1 Tclin Muscarinic acetylcholine receptor M1 (12690 Activities)

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TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)

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DRD1 Tclin Dopamine D1 receptor (9720 Activities)

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KCNH2 Tclin HERG (29587 Activities)

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GSK3B Tclin Glycogen synthase kinase-3 beta (11785 Activities)

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ARSA Tbio Cerebroside-sulfatase (655 Activities)

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GSK3A Tclin Glycogen synthase kinase-3 alpha (3764 Activities)

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CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)

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CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)

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CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)

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CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)

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CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)

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NB-4 (999 Activities)

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SH-SY5Y (11521 Activities)

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FEN1 Tchem Flap endonuclease 1 (12055 Activities)

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EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

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Associated Targets(non-human)

Mus musculus (284745 Activities)

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Rattus norvegicus (775804 Activities)

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pfk 6-phospho-1-fructokinase (7870 Activities)

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Impa1 Inositol monophosphatase 1 (16203 Activities)

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Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Hygroscopic；Moisture sensitive
• Boil Point(°C): 1360℃
• Melt Point(°C): 605 °C (lit.)
• Molecular Weight: 42.400 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 41.9849 Da
• Monoisotopic Mass: 41.9849 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 2
• Formal Charge: 0
• Complexity: 2.000
• 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

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