RefChem:165703
pentapotassium;hydron;nickel(2+);N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
Also Known As: Pentapotassium nickelous 1,2-ethane di(nitrilodi(methylene phosphonate))|Nickelate(6-), (((1,2-ethanediylbis((nitrilo-kappaN)bis(methylene)))tetrakis(phosphonato-kappaO))(8-))-, pentapotassium hydrogen, (OC-6-21)-|Nickelate(6-), (((1,2-ethanediylbis((nitrilo-kappaN)bis(methylene)))tetrakis(phosphonato-kappaO))(8-))-, potassium hydrogen (1:5:1), (OC-6-21)-|HYDROGEN PENTAPOTASSIUM [[[ETHYLENEBIS[NITRILOBIS(METHYLENE)]]TETRAKIS[PHOSPHONATO]](8-)]NICKELATE(6-)|Nickelate(6-), [[[1,2-ethanediylbis[(nitrilo-.kappa.N)bis(methylene)]]tetrakis[phosphonato-.kappa.O]](8-)]-, pentapotassium hydrogen, (OC-6-21)-|Hydrogen pentapotassium (((ethylenebis(nitrilobis(methylene)))tetrakis(phosphonato))(8-))nickelate(6-)|Hydrogen pentapotassium[[[ethylenebis[nitrilobis(methylene)]]tetrakis[phosphonato]](8-)]nickelate(6-)|Nickelate(6-), [[[1,2-ethanedibybis[nitrilobis (methylene)]]tetrakis[phosphonato]] (8-)]-, pentapotassium hydrogen, (OC-6-21)-|Nickelate(6-), [[[1,2-ethanediylbis[(nitrilo-.kappa.N)bis(methylene)]]tetrakis[phosphonato-.kappa.O]](8-)]-, potassium hydrogen (1:5:1), (OC-6-21)-|Nickelate(6-), [[[1,2-ethanediylbis[(nitrilo-kappaN)bis(methylene)]]tetrakis[phosphonato-kappaO]](8-)]-, potassium hydrogen (1:5:1), (OC-6-21)-|Nickelate(6-), [[[1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis[phosphonato]](8-)-N,N',OP,OP',OP'',OP''']-, pentapotassium hydrogen, (OC-6-21)-|Nickelate(6-), [[[1,2-ethanediylbis[nitrilobis(methylene)]]tetrakis[phosphonato]](8-)]-, pentapotassium hydrogen, (OC-6-21)-|pentapotassium; hydron; nickel(2+); N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine
| Molecular Formula | C6H13K5N2NiO12P4 |
|---|---|
| Molecular Weight | 681.6958 g/mol |
| LogP | -21.7948 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 7 |
| Exact Mass | 681.6958 |
| Monoisotopic Mass | 681.6958 |
| Heavy Atoms | 30 |
| Complexity | 440.0 |
Chemical Identifiers
| CAS Number | 68958-87-2 |
|---|---|
| SMILES | [H+].C(CN(CP(=O)([O-])[O-])CP(=O)([O-])[O-])N(CP(=O)([O-])[O-])CP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].[Ni+2] |
| InChIKey | OKQSEMOGVIXKTK-UHFFFAOYSA-G |
Product Overview
RefChem:165703 (CAS 68958-87-2), with molecular formula C6H13K5N2NiO12P4 and molecular weight 681.6958 g/mol. IUPAC: pentapotassium;hydron;nickel(2+);N,N,N',N'-tetrakis(phosphonatomethyl)ethane-1,2-diamine.
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