Ferrocenemonocarboxylic acid

CAS Registry Number®

1271-42-7

CAS Name

Ferrocenemonocarboxylic acid

Molecular Formula

C11H10FeO2

Cite this Page

Ferrocenemonocarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1271-42-7 (retrieved 2024-11-30) (CAS RN: 1271-42-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >200 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C6H5O2.C5H5.Fe/c7-6(8)5-3-1-2-4-5;1-2-4-5-3-1;/h1-4H,(H,7,8);1-5H;/q2*-1;+2

InChIKey

InChIKey=BAJHDUZEIKRKAS-UHFFFAOYSA-N

SMILES

C(O)(=O)[C-]12[Fe+2]3456789([CH]1=[CH]3[CH]4=[CH]52)[CH-]%10[CH]6=[CH]7[CH]8=[CH]9%10

Canonical SMILES

O=C(O)[C-]12[CH]3=[CH]4[CH]5=[CH]1[Fe+2]67894532[CH]=%10[CH]9=[CH]8[CH-]7[CH]%106

Other Names for this Substance

  • Ferrocene, carboxy-
  • Ferrocenecarboxylic acid
  • Iron, (carboxycyclopentadienyl)cyclopentadienyl-
  • Cyclopentadienecarboxylic acid, cyclopentadienyliron deriv.
  • Ferrocenoic acid

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Deleted or Replaced CAS Registry Numbers

119390-45-3

CAS INSIGHTSTM
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