1,1′-Dimethylferrocene

CAS Registry Number®

1291-47-0
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CAS Name

1,1′-Dimethylferrocene

Molecular Formula

C12H14Fe

Cite this Page

1,1′-Dimethylferrocene.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1291-47-0 (retrieved 2024-04-28) (CAS RN: 1291-47-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    70-80 °C @ Press: 2 Torr

  • Melting Point (2)

    34-35 °C

  • Density (3)

    1.2349 g/cm³ @ Temp: 35 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/2C6H7.Fe/c2*1-6-4-2-3-5-6;/h2*2-5H,1H3;/q2*-1;+2

InChIKey

InChIKey=YTOVAWUSMUMHIM-UHFFFAOYSA-N

SMILES

C[C-]12[Fe+2]3456789([C-]%10(C)[CH]3=[CH]4[CH]5=[CH]6%10)[CH]1=[CH]7[CH]8=[CH]92

Canonical SMILES

C[C-]12[CH]3=[CH]4[CH]5=[CH]1[Fe+2]45678932[CH]=%10[CH]9=[CH]8[C-]7(C)[CH]%106

Other Names for this Substance

  • Ferrocene, 1,1′-dimethyl-
  • Iron, bis(methylcyclopentadienyl)-
  • 1,1′-Dimethylferrocene
  • Bis(methylcyclopentadienyl)iron
  • Dimethylferrocene

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