Cyclopentadienyllithium , CAS No.16733-97-4

CAS: 16733-97-4 Cat. No.: C752770 分子式: C₅H₅Li 分子量: 72.03 EC番号: 627-659-2

Synonyms

Lithium cyclopentadiene

Storage

Store at 2-8°C,Protected from light,Argon charged,Desiccated

Shipped In

Wet ice

仕様

同義語

Lithium cyclopentadiene

保管条件

Store at 2-8°C,Protected from light,Argon charged,Desiccated

入荷

Wet ice

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

528773263

カノニカル・スマイル

[Li+].[CH-]1C=CC=C1

IUPAC Name

lithium;cyclopenta-1,3-diene

InChIKey

DBKDYYFPDRPMPE-UHFFFAOYSA-N

INCHI

1S/C5H5.Li/c1-2-4-5-3-1;/h1-5H;/q-1;+1

異性体SMILES

[Li+].[CH-]1C=CC=C1

WGKドイツ

3

UN番号

3263

包装グループ

II

分子量

72.03

Reaxy-Rn

3562622

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3562622&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 Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Organic lithium salt - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic 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

• 溶解度: Insoluble in water.
• 感度: Air & Moisture Sensitive
• 分子量: 72.100 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 72.0551 Da
• Monoisotopic Mass: 72.0551 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 23.100
• 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