Cas no 102744-98-9 (Ferrate(4-),bis[N,N-bis(carboxymethyl)glycinato(3-)-N,O,O']-, disodium dihydrogen (9CI))

Ferrate(4-),bis[N,N-bis(carboxymethyl)glycinato(3-)-N,O,O']-, disodium dihydrogen (9CI) structure
102744-98-9 structure
Product Name:Ferrate(4-),bis[N,N-bis(carboxymethyl)glycinato(3-)-N,O,O']-, disodium dihydrogen (9CI)
CAS No:102744-98-9
MF:C12H12FeN2Na4O12
MW:524.033968925476
CID:176494
PubChem ID:59701
Update Time:2025-04-19

Ferrate(4-),bis[N,N-bis(carboxymethyl)glycinato(3-)-N,O,O']-, disodium dihydrogen (9CI) Chemical and Physical Properties

Names and Identifiers

    • Ferrate(4-),bis[N,N-bis(carboxymethyl)glycinato(3-)-N,O,O']-, disodium dihydrogen (9CI)
    • tetrasodium,2-[bis(carboxylatomethyl)amino]acetate,iron(2+)
    • 2-[bis(2-oxido-2-oxoethyl)amino]acetate
    • AC1L1RRQ
    • ACETIC ACID, NITRILOTRI-, DISODIUM SALT, IRON(II) chelate
    • Disodium nitrilotriacetate iron(II) chelate
    • iron(2+) sodium 2,2',2''-nitrilotriacetate (1:4:2)
    • LS-12586
    • tetrasodium
    • 102744-98-9
    • DTXSID80145483
    • Inchi: 1S/2C6H9NO6.Fe.4Na/c2*8-4(9)1-7(2-5(10)11)3-6(12)13;;;;;/h2*1-3H2,(H,8,9)(H,10,11)(H,12,13);;;;;/q;;+2;4*+1/p-6
    • InChI Key: HAUTZSZVTVUUJE-UHFFFAOYSA-H
    • SMILES: [Fe+2].[Na+].[Na+].[Na+].[Na+].[O-]C(CN(CC(=O)[O-])CC(=O)[O-])=O.[O-]C(CN(CC(=O)[O-])CC(=O)[O-])=O

Computed Properties

  • Exact Mass: 521.93776
  • Monoisotopic Mass: 523.933045
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 14
  • Heavy Atom Count: 31
  • Rotatable Bond Count: 6
  • Complexity: 171
  • Covalently-Bonded Unit Count: 7
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 247

Experimental Properties

  • Boiling Point: 498.2°Cat760mmHg
  • Flash Point: 255.1°C
  • PSA: 247.26
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