Bis(cyclopentadienyl)nickel(II) - ≥98% , CAS No.1271-28-9

CAS: 1271-28-9 Cat. No.: B115565 Molecular Weight: 188.88 EC Number: 215-039-0

GRADE & PURITY ≥98%

Synonyms

Nickelocene

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Overview

This metal alkyl may be used to synthesize hybrid organic-inorganic polymeric molecular layer deposition (MLD). Bis(cyclopentadienyl) nickel (Cp 2 Ni) may be used as a Ni precursor for the atomic layer deposition (ALD) of NiO/carbon nanotubes hybrids.

Specifications

Synonyms

Nickelocene

Specifications & Purity

≥98%

Storage

Store at -20°C, Argon charged

Shipped In

Ice chest + Ice pads

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ni+2]
• IUPAC Name: cyclopenta-1,3-diene;nickel(2+)
• InChIKey: KZPXREABEBSAQM-UHFFFAOYSA-N
• INCHI: 1S/2C5H5.Ni/c2*1-2-4-5-3-1;/h2*1-5H;/q2*-1;+2
• Isomeric SMILES: [CH-]1C=CC=C1.[CH-]1C=CC=C1.[Ni+2]
• WGK Germany: 3
• RTECS: QR6500000
• UN Number: 1325
• Packing Group: II
• Molecular Weight: 188.88
• Reaxy-Rn: 16932738
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=16932738&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Class Aromatic hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Class: Aromatic hydrocarbons
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Aromatic hydrocarbons
• Alternative Parents: Unsaturated hydrocarbons Organic salts Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon derivative - Organic salt - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aromatic hydrocarbons. These are aromatic compounds that are made up of carbon and hydrogen atoms only.
• 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: Insoluble in water; Very slightly soluble in Toluene
• Sensitivity: air & moisture & light sensitive
• Melt Point(°C): 171-173°C
• Molecular Weight: 188.880 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 188.014 Da
• Monoisotopic Mass: 188.014 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 11.600
• 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: 3

XLogP3

References

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