Cyclopentadienyllithium , CAS No.16733-97-4

CAS: 16733-97-4 Cat. No.: C752770 분자식: C₅H₅Li 분자량: 72.03 EC 번호: 627-659-2

Synonyms

Lithium cyclopentadiene

Storage

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

Shipped In

Wet ice

사양

동의어

Lithium cyclopentadiene

보관 조건

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

배송

Wet ice

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

이름과 식별자

Pubchem Sid

528773263

정식 스마일

[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

이성체 SMILES

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

WGK 독일

3

UN 번호

3263

포장 그룹

II

분자량

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
    • 분류 Organic metal salts
      • Subclass Organic alkali metal salts

• Kingdom: Organic compounds
• Superclass: Organic salts
• 분류: 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
• 설명: 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

화학 및 물리적 특성

• 용해성: Insoluble in water.
• 감도: Air & Moisture Sensitive
• 분자량: 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