Tetradecasodium [2-{2-[{2-[bis(phosphonatomethyl)amino]ethyl}(phosphonatomethyl)amino]ethyl}-10,10,10-trioxido-5,8-bis(phosphonatomethyl)-2,5,8-triaza-10lambda⁵-phosphadec-1-yl]phosphonate
[CAS# 93939-90-3]

Identification

• Name: Tetradecasodium [2-{2-[{2-[bis(phosphonatomethyl)amino]ethyl}(phosphonatomethyl)amino]ethyl}-10,10,10-trioxido-5,8-bis(phosphonatomethyl)-2,5,8-triaza-10lambda⁵-phosphadec-1-yl]phosphonate
• Synonyms: tetradecasodium [[(phosphonatomethyl)imino]bis[ethylene[(phosphonatomethyl)imino]ethylenenitrilobis(methylene)]]tetrakisphosphonate
• Molecular Formula: C₁₅H₃₀N₅Na₁₄O₂₁P₇
• Molecular Weight: 1155.09
• CAS Registry Number: 93939-90-3
• EINECS: 300-381-6
• SMILES: [Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[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/C15H44N5O21P7.14Na/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);;;;;;;;;;;;;;/q;14*+1/p-14
• InChIKey: RZJDLGPFMTYOCN-UHFFFAOYSA-A