Cas no 22205-04-5 (1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI))

1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI) structure
22205-04-5 structure
Product Name:1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI)
CAS No:22205-04-5
MF:C12H10Fe3O14
MW:555.004043102264
CID:268039
PubChem ID:11353432
Update Time:2025-04-19

1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI) Chemical and Physical Properties

Names and Identifiers

    • 1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI)
    • 1,2,3-propanetricarboxylate, 2-hydroxy-, iron(2+)-~59~Fe salt (1:1)
    • Ferrous citrate, Fe-59
    • Ferrous-59 citrate
    • UNII-PW94HT3KE9
    • Ferrous citrate Fe 59
    • FERROUS CITRATE,FE-59 [VANDF]
    • Ferrous citrate Fe 59 [USAN:USP]
    • 22205-04-5
    • FERROUS CITRATE, FE-59 [ORANGE BOOK]
    • PW94HT3KE9
    • Ferrous citrate fe59
    • Ferrous citrate,fe-59
    • Iron(2+)-(sup 59)Fe citrate
    • FERROUS CITRATE FE 59 [USAN]
    • ferrous citrate fe-59
    • Q27286784
    • Iron(ii) citrate fe 59
    • Ferrutope
    • Inchi： 1S/2C6H8O7.3Fe/c2*7-3(8)1-6(13,5(11)12)2-4(9)10;;;/h2*13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;;/q;;3*+2/p-6/i;;3*1+3
    • InChI Key： PFKAKHILNWLJRT-ZHVHGXCCSA-H
    • SMILES： [59Fe+2].[59Fe+2].[59Fe+2].OC(C(=O)[O-])(CC(=O)[O-])CC(=O)[O-].OC(C(=O)[O-])(CC(=O)[O-])CC(=O)[O-]

Computed Properties

  • Exact Mass: 247.938408
  • Monoisotopic Mass: 247.938408
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 211
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 141

Experimental Properties

  • Boiling Point: 309.6°Cat760mmHg
  • Flash Point: 155.2°C

1,2,3-Propanetricarboxylicacid, 2-hydroxy-, iron(2+)-59Fe salt (1:1) (9CI) Related Literature

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