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106879

Sigma-Aldrich

1,1′-Diacetylferrocene

97%

Synonym(s):

Bis(acetylcyclopentadienyl)iron

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About This Item

Empirical Formula (Hill Notation):
C14H14FeO2
CAS Number:
1273-94-5
Molecular Weight:
270.10
MDL number:
MFCD00001424
UNSPSC Code:
12352300
PubChem Substance ID:
24846744

Quality Level

100

assay

97%

reaction suitability

core: iron
reagent type: catalyst

mp

122-128 °C

SMILES string

[Fe].CC(=O)[C]1[CH][CH][CH][CH]1.CC(=O)[C]2[CH][CH][CH][CH]2

InChI

1S/2C7H7O.Fe/c2*1-6(8)7-4-2-3-5-7;/h2*2-5H,1H3;

InChI key

JNBIZDIDVCJECQ-UHFFFAOYSA-N

Related Categories

General description

1,1′-Diacetylferrocene is an organic compound used as a catalyst or ligand in certain cross-coupling reactions.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Yulia P Tupolova et al.
Dalton transactions (Cambridge, England : 2003), 49(44), 15592-15596 (2020-11-04)
Herein, we report the synthesis and magnetic properties of the Co(ii) coordination compound with the 1,1'-bis(1-((pyrid-2-ylmethylene)hydrazono)ethyl)ferrocene (L) ligand, having the general formula [CoLCl2]. The static magnetic data analysis supported by the CASSCF/NEVPT2 calculations revealed the presence of the triaxial magnetic

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