Tricarbonyl(cyclooctatetraene)iron

Synonym: Cyclooctatetraene iron tricarbonyl, 1,3,5,7-Cyclooctatetraeneiron tricarbonyl, Cyclooctatetraene tricarbonyliron, Cyclooctatetraenetricarbonyliron
CAS Number 12093-05-9 | MDL Number MFCD00001755 | EC Number 621-975-4

Tricarbonyl(cyclooctatetraene)iron Chemical Structure

Product CodeFE3059
CAS Number12093-05-9
Assay (purity)96%
Purity methodby elemental analysis
Molecular weight244.02
Formsolid
Appearancered-brown crystals
Melting point93-95C
Elemental analysis%C=51.7–56.6; %H=3.2–3.4
NMRconforms to structure
Molecular formulaC11H8FeO3
Linear formulaC8H8Fe(CO)3
Download Specification FE3059
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Safety information

Signal wordWARNING
Pictograms
Hazard statementsH302, H312, H332
Precautionary statementsP261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, P501
UNNOT REGULATED
In TSCA registryNo (sold for research and development usage only)

Certificates of analysis (CoA)

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External identifiers for Cyclooctatetraene iron tricarbonyl

Pubchem CID11436476
SMILES[Fe].[O]#C.[O]#C.[O]#C.C/1=C/C=CC=C/C=C1
InchI IdentifierInChI=1S/C8H8.3CO.Fe/c1-2-4-6-8-7-5-3-1;3*1-2;/h1-8H;;;;/b2-1-,3-1?,4-2?,5-3-,6-4-,7-5?,8-6?,8-7-;;;;
InchI KeyXAOCYVWRKJTXOL-JGZYGLCTSA-N

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