P,P'-[[(phosphonatomethyl)imino]bis[2,1-ethanediyl[[2-[bis(phosphonatomethyl)amino]ethyl]imino]methylene]]bis-Phosphonate ammonium salt (1:8)
[CAS# 93776-89-7]

Identification

• Name: P,P'-[[(phosphonatomethyl)imino]bis[2,1-ethanediyl[[2-[bis(phosphonatomethyl)amino]ethyl]imino]methylene]]bis-Phosphonate ammonium salt (1:8)
• Synonyms: octaammonium tetrahydrogen [2,5,8,11,14-pentakis(phosphonatomethyl)-2,5,8,11,14-pentaazapentadecane-1,15-diyl]bisphosphonate
• Molecular Formula: C₁₅H₆₂N₁₃O₂₁P₇
• Molecular Weight: 977.55
• CAS Registry Number: 93776-89-7
• EINECS: 298-016-8
• SMILES: [NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+].[O-]P([O-])(=O)CN(CP(=O)([O-])[O-])CCN(CCN(CCN(CCN(CP([O-])([O-])=O)CP([O-])([O-])=O)CP([O-])([O-])=O)CP([O-])([O-])=O)CP([O-])([O-])=O
• InChI: 1S/C15H44N5O21P7.8H3N/c21-42(22,23)9-16(1-3-17(10-43(24,25)26)5-7-19(12-45(30,31)32)13-46(33,34)35)2-4-18(11-44(27,28)29)6-8-20(14-47(36,37)38)15-48(39,40)41;;;;;;;;/h1-15H2,(H2,21,22,23)(H2,24,25,26)(H2,27,28,29)(H2,30,31,32)(H2,33,34,35)(H2,36,37,38)(H2,39,40,41);8*1H3/p-6
• InChIKey: IKZIZKNJWQNFME-UHFFFAOYSA-H

Properties

• Boiling point: 1381.3°C at 760 mmHg (Cal.)
• Flash point: 789.2°C (Cal.)