Cas no 1274-00-6 (Ferrocene, pentyl-)

Ferrocene, pentyl- structure
Ferrocene, pentyl- structure
Product Name:Ferrocene, pentyl-
CAS No:1274-00-6
MF:C15H20Fe
MW:256.164305686951
CID:152823
PubChem ID:102595
Update Time:2025-04-19

Ferrocene, pentyl- Chemical and Physical Properties

Names and Identifiers

    • Ferrocene, pentyl-
    • iron(2+) cyclopenta-2,4-dienide 2-pentylcyclopenta-2,4-dienide (1:1:1)
    • Pentylferrocene
    • n-Amylferrocene
    • n-Pentylferrocene
    • EINECS 215-058-4
    • cyclopenta-1,3-diene;iron(2+);1-pentylcyclopenta-1,3-diene
    • 1274-00-6
    • Inchi: 1S/C10H15.C5H5.Fe/c1-2-3-4-7-10-8-5-6-9-10;1-2-4-5-3-1;/h5-6,8-9H,2-4,7H2,1H3;1-5H;/q2*-1;+2
    • InChI Key: JHYFIGYFHLCBRI-UHFFFAOYSA-N
    • SMILES: [Fe+2].C(CCCC)C1=CC=C[CH-]1.[CH-]1C=CC=C1

Computed Properties

  • Exact Mass: 252.08054
  • Monoisotopic Mass: 256.091436g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 129
  • Covalently-Bonded Unit Count: 3
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0?2

Experimental Properties

  • Refractive Index: 1.5711 (589.3 nm 20 oC)
  • PSA: 0
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