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Reference substance information

IUPAC name:
Diethylenetriamine tetramethylene phosphonic acid, pentasodium salt
Synonyms
Names:
Identifier:
IUPAC name
Diethylenetriamine tetramethylene phosphonic acid, pentasodium salt
Identifier:
common name
DTPMP-tetraphosphonate-5Na

Molecular and structural information

Molecular formula:
C8H20N3Na5O12P4
Molecular weight:
ca. 589.1
SMILES notation:
DTPMP-tetraphosphonate-5Na (Isomer 1)
[O-]P(=O)(CN(CP(=O)(O)[O-])CCNCCN(CP(=O)(O)[O-])CP(=O)(O)[O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+]

DTPMP-tetraphosphonate-5Na (Isomer 2)
[O-]P(=O)(CN(CCN(CP(=O)(O)[O-])CP(=O)(O)[O-])CCNCP(=O)(O)[O-])[O-].[Na+].[Na+].[Na+].[Na+][Na+]
Structural formula:
Chemical structure