Acetylferrocene
CAS #: 1271-55-2
Product Code : EFe-A51-CU-CU
CAS #: 1271-55-2
Linear Formula: C12H12FeO
MDL Number: MFCD00001432
EC No.: 215-043-2
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Synonyms
(Acetylcyclopentadienyl)cyclopentadienyliron; 1-Ferrocenylethanone; Acetoferrocene; ferrocene, acetyl-; Ferrocenyl methyl ketone; Iron, (acetylcyclopentadienyl)cyclopentadienyl-; [(η5-C5H5)Fe{(η5-C5H4)COCH3}]
Compound Formula: C12H12FeO
Molecular Weight: 228.07
Appearance: Orange to brown powder, crystals, or chunks
Melting Point: 81-83 °C
Boiling Point: 160-163°C /4mm
Density: N/A
Solubility in H2O: N/A
Exact Mass: 228.023753
Monoisotopic Mass: 228.023753
Health & Safety Information
Signal Word: Danger
Hazard Statements: H300
Hazard Codes: T+
Risk Codes: 28
Safety Statements: 28-36/37-45
RTECS Number: OB3700000
Transport Information: UN 2811 6.1/PG 2
WGK Germany: 3
Chemical Identifiers
Linear Formula: C12H12FeO
Pubchem CID: 10857189
MDL Number: MFCD00001432
EC No.: 215-043-2
IUPAC Name: cyclopentane; 1-cyclopentylethanone; iron
SMILES: CC(=O)[C]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe]
InchI Identifier: InChI=1S/C7H7O.C5H5.Fe/c1-6(8)7-4-2-3-5-7;1-2-4-5-3-1;/h2-5H,1H3;1-5H;
InchI Key: PHMAOJNZIFULOG-UHFFFAOYSA-N