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Substance Name: Pentasodium diethylenetriaminepentamethylenephosphonate
RN: 61792-09-4
UNII: 96V6W55893
InChIKey: QRIAWZKHYOWOAR-UHFFFAOYSA-I

Molecular Formula

  • C9-H28-N3-O15-P5.5Na

Molecular Weight

  • 683.1067
 
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Names and Synonyms

Name of Substance

  • Pentasodium diethylenetriaminepentamethylenephosphonate

Synonyms

  • EC 263-212-4
  • EINECS 263-212-4
  • UNII-96V6W55893

Systematic Names

  • Pentasodium pentahydrogen (((phosphonatomethyl)imino)bis(ethane-2,1-diylnitrilobis(methylene)))tetrakisphosphonate
  • Phosphonic acid, (((phosphonomethyl)imino)bis(2,1-ethanediylnitrilobis(methylene)))tetrakis-, pentasodium salt

Registry Numbers

CAS Registry Number

  • 61792-09-4

FDA UNII

  • 96V6W55893

System Generated Number

  • 0061792094

Molecular Formulas

Molecular Formula

  • C9-H28-N3-O15-P5.5Na

Molecular Formula Fragments

  • C9-H28-N3-O15-P5
  • COMPONENT
  • Na

Structure Descriptors

InChI

1S/C9H28N3O15P5.5Na/c13-28(14,15)5-10(1-3-11(6-29(16,17)18)7-30(19,20)21)2-4-12(8-31(22,23)24)9-32(25,26)27;;;;;/h1-9H2,(H2,13,14,15)(H2,16,17,18)(H2,19,20,21)(H2,22,23,24)(H2,25,26,27);;;;;/q;5*+1/p-5

InChIKey

QRIAWZKHYOWOAR-UHFFFAOYSA-I

Smiles

C(CN(CP(=O)(O)[O-])CP(=O)(O)[O-])N(CCN(CP(=O)(O)[O-])CP(=O)(O)[O-])CP(=O)(O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]