1,1′-Diacetylferrocene
CAS Registry Number®
1273-94-5
CAS Name
1,1′-DiacetylferroceneMolecular Formula
C14H14FeO2Cite this Page
1,1′-Diacetylferrocene. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1273-94-5 (retrieved ) (CAS RN: 1273-94-5). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
127-127.5 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/2C7H7O.Fe/c2*1-6(8)7-4-2-3-5-7;/h2*2-5H,1H3;/q2*-1;+2
InChIKey
InChIKey=WDKIARLEQFHVKC-UHFFFAOYSA-N
SMILES
C(C)(=O)[C-]12[Fe+2]3456789([C-]%10(C(C)=O)[CH]3=[CH]4[CH]5=[CH]6%10)[CH]1=[CH]7[CH]8=[CH]92
Canonical SMILES
O=C(C)[C-]12[CH]3=[CH]4[CH]5=[CH]1[Fe+2]45678932[CH]=%10[CH]9=[CH]8[C-]7(C(=O)C)[CH]%106
Other Names for this Substance
- Ferrocene, 1,1′-diacetyl-
- Iron, bis(cyclopentadienyl methyl ketone)-
- 1,1′-Diacetylferrocene
- DAF
- NSC 16677
Deleted or Replaced CAS Registry Numbers
49564-20-7