Hexasodium [[[2-[[[Bis(Hydroxymethyl)Phosphino]Methyl](Phosphonatomethyl)Amino]Ethyl]Imino]Bis(Methylene)]Bisphosphonate
[CAS# 50655-31-7]

Identification

• Name: Hexasodium [[[2-[[[Bis(Hydroxymethyl)Phosphino]Methyl](Phosphonatomethyl)Amino]Ethyl]Imino]Bis(Methylene)]Bisphosphonate
• Synonyms: Hexasodium [[2-(Bis(Phosphonatomethyl)Amino)Ethyl-(Phosphonatomethyl)Amino]Methyl-Methylol-Phosphanyl]Methanol; Hexasodium (((2-(((Bis(Hydroxymethyl)Phosphino)Methyl)(Phosphonatomethyl)Amino)Ethyl)Imino)Bis(Methylene))Bisphosphonate
• Molecular Formula: C₈H₁₈N₂Na₆O₁₁P₄
• Molecular Weight: 580.07
• CAS Registry Number: 50655-31-7
• EINECS: 256-689-5
• SMILES: C([P]([O-])([O-])=O)N(C[P]([O-])([O-])=O)CCN(C[P]([O-])([O-])=O)CP(CO)CO.[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C8H24N2O11P4.6Na/c11-7-22(8-12)3-9(4-23(13,14)15)1-2-10(5-24(16,17)18)6-25(19,20)21;;;;;;/h11-12H,1-8H2,(H2,13,14,15)(H2,16,17,18)(H2,19,20,21);;;;;;/q;6*+1/p-6
• InChIKey: OAOWBBVRGJRMNJ-UHFFFAOYSA-H

Properties

• Boiling point: 800.6°C at 760 mmHg (Cal.)
• Flash point: 438°C (Cal.)