Cas no 13078-36-9 (Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3))

Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3) structure
13078-36-9 structure
Product Name:Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3)
CAS No:13078-36-9
MF:C14H20N3Na3O10
MW:459.292016983032
CID:234651
PubChem ID:145925537
Update Time:2025-04-19

Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3) Chemical and Physical Properties

Names and Identifiers

    • Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3)
    • Trisodium dihydrogen -N,N-(bis(2-(bis(carboxylatomethyl)amino)ethyl))glycinate
    • Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl-,trisodium salt
    • PC-45
    • PC 45
    • EINECS 235-979-5
    • TRISODIUM DIHYDROGEN-N,N-(BIS(2-(BIS(CARBOXYLATOMETHYL)AMINO)ETHYL))GLYCINATE
    • Pentetate trisodium
    • TRISODIUM DTPA
    • 13078-36-9
    • TRISODIUM DIETHYLENE TRIAMINEPENTAACETATE
    • DIETHYLENETRIAMINEPENTAACETIC ACID TRISODIUM SALT
    • Chelest PC 45
    • 79FZD535SC
    • UNII-79FZD535SC
    • Inchi： 1S/C14H23N3O10.3Na/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27;;;/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27);;;/q;3*+1/p-3
    • InChI Key： HFNVACONKMSOTH-UHFFFAOYSA-K
    • SMILES： [Na+].[Na+].[Na+].[O-]C(CN(CCN(CC(=O)[O-])CC(=O)[O-])CCN(CC(=O)[O-])CC(=O)[O-])=O.[H+].[H+]

Computed Properties

  • Exact Mass: 459.08417669g/mol
  • Monoisotopic Mass: 459.08417669g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 13
  • Heavy Atom Count: 30
  • Rotatable Bond Count: 11
  • Complexity: 454
  • Covalently-Bonded Unit Count: 6
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 210?2

Glycine,N,N-bis[2-[bis(carboxymethyl)amino]ethyl]-, sodium salt (1:3) Related Literature

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