Analyte Name

Diethylenetriaminepenta(Methylenephosphonic Acid) Sodium Salt

CAS Number

22042-96-2

Molecular Formula

C9H18N3O15P5 • xNa

Molecular Weight

597.19

Accurate Mass

597.01

SMILES

O=P(O)(CN(CCN(CP(O)(O)=O)CP(O)(O)=O)CCN(CP(O)(O)=O)CP(O)(O)=O)O.[Na]

InChI

InChI=1S/C9H28N3O15P5.Na/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);

IUPAC

((bis(2-(bis(phosphonomethyl)amino)ethyl)amino)methyl)phosphonic acid, sodium salt

Alternate CAS Number

15827-60-8

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat