tert-Butyllithium solution - 1.3M in Pentane , CAS No.594-19-4

CAS: 594-19-4 Cat. No.: B109777 分子式: C₄H₉Li 分子量: 64.06 Beilstein Registry Number: 3587204 EC番号: 209-831-5

GRADE & PURITY 1.3M in Pentane

Synonyms

tertbutyllithium | tert-Butyllithium | t-Butyllitium | Lithium, (1,1-dimethylethyl)- | t-butyllithiurn | lithium;2-methylpropane | tBuLi | t-BuLi | t-butyllithium | t-butyl-lithium | t-butyl lithium | tert-butyllitium | t-butyllithum | Tert butyllithium

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice,FedEx DG Service

概要

tert-Butyllithium solution (tert-BuLi) is an organolithium compound, used as a strong base in organic chemistry. It facilitates lithium-halogen exchange reaction and also can be employed in the deprotonation of C-H compounds and amines.
Application
tert-Butyllithium solution can be used as a strong base in the synthesis of: Alkyllithium derivatives form alkyl iodides and diiodoalkanes by halogen-lithium exchange reaction. Inorganic polymer [(LiMo3Se3)n] from [(InMo3Se3)n] by reductive intercalation method. Adducts of cinnamic acid (1,3- and 1,4-adducts) by reacting with C-C double of cinnamic acid.

Specifications

同義語

tertbutyllithium | tert-Butyllithium | t-Butyllitium | Lithium, (1,1-dimethylethyl)- | t-butyllithiurn | lithium;2-methylpropane | tBuLi | t-BuLi | t-butyllithium | t-butyl-lithium | t-butyl lithium | tert-butyllitium | t-butyllithum | Tert butyllithium

仕様と純度

1.3M in Pentane

保管条件

Store at 2-8°C,Argon charged

入荷

Wet ice,FedEx DG Service

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

名前と識別子

• パブケム・シド: 508812841
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/508812841
• カノニカル・スマイル: [Li+].C[C-](C)C
• IUPAC Name: lithium;2-methylpropane
• InChIKey: UBJFKNSINUCEAL-UHFFFAOYSA-N
• INCHI: 1S/C4H9.Li/c1-4(2)3;/h1-3H3;/q-1;+1
• 異性体SMILES: [Li+].C[C-](C)C
• WGKドイツ: 2
• 分子量: 64.06
• Beilstein: 3587204
• Reaxy-Rn: 3587204
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3587204&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic salts
    • 分類 Organic metal salts
      • Subclass Organic alkali metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• 分類: Organic metal salts
• Subclass: Organic alkali metal salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic lithium salts
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Organic lithium salt - Hydrocarbon derivative - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as organic lithium salts. These are organic compounds containing a lithium ion.
• 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

化学的性質と物理的性質

• 感度: Moisture, Heat and Air sensitive
• 分子量: 64.099 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 64.0864 Da
• Monoisotopic Mass: 64.0864 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 8.400
• 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: 2

XLogP3

参考文献

1. Ning Yan, Lei Ding, Tong Wu, Sihang Zhang, Feng Yang, Ya Cao, Ming Xiang.  (2021)  Shutdown-Functionalized Poly Ethylene-Vinyl Alcohol Sulfonate Lithium and Poly (Vinyl Alcohol) Composite Lithium-Ion Battery Separator.  JOURNAL OF THE ELECTROCHEMICAL SOCIETY,  168  (11): (110510).  [PMID:] [10.1149/1945-7111/ac330c]

2. Haoyun Deng, Zhixiong Yang, Mengzhen Zhou, Encai Ou, Yanbing Lu, Qiulan Zhou, Kun Liu, Weijian Xu.  (2024)  Anionic polymerization of (Z)-1,3-pentadiene using Ba/Al/Li trimetallic initiators to synthesize crystalline high trans-1,4-polypentadiene.  POLYMER,      [PMID:] [10.1016/j.polymer.2024.127841]