bis(dihydrogen phosphate);nickel(2+)

H4NiO8P2 — CID 14367986

IUPACbis(dihydrogen phosphate);nickel(2+)
SMILESO=P([O-])(O)O.O=P([O-])(O)O.[Ni+2]
InChIInChI=1S/Ni.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2
InChIKeyLCFKXCNZLIBDOX-UHFFFAOYSA-L
MW252.67 g/mol
LogP-3.12
Rot. Bonds

About bis(dihydrogen phosphate);nickel(2+)

bis(dihydrogen phosphate);nickel(2+) (PubChem CID 14367986) has the molecular formula H4NiO8P2 and a molecular weight of 252.67 g/mol. Its IUPAC name is bis(dihydrogen phosphate);nickel(2+).

Molecular Properties

Compound Namebis(dihydrogen phosphate);nickel(2+)
PubChem CID14367986
Molecular FormulaH4NiO8P2
Molecular Weight252.67 g/mol
Exact Mass251.87
IUPAC Namebis(dihydrogen phosphate);nickel(2+)
SMILESO=P([O-])(O)O.O=P([O-])(O)O.[Ni+2]
InChIInChI=1S/Ni.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2
InChIKeyLCFKXCNZLIBDOX-UHFFFAOYSA-L
XLogP-3.12
TPSA161.18 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.67
LogP ≤ 5-3.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis(dihydrogen phosphate);nickel(2+)?
The IUPAC name of bis(dihydrogen phosphate);nickel(2+) (CID 14367986) is bis(dihydrogen phosphate);nickel(2+).
What is the SMILES notation for bis(dihydrogen phosphate);nickel(2+)?
The canonical SMILES for bis(dihydrogen phosphate);nickel(2+) is O=P([O-])(O)O.O=P([O-])(O)O.[Ni+2].
What is the InChIKey of bis(dihydrogen phosphate);nickel(2+)?
The InChIKey is LCFKXCNZLIBDOX-UHFFFAOYSA-L. The full InChI is InChI=1S/Ni.2H3O4P/c;2*1-5(2,3)4/h;2*(H3,1,2,3,4)/q+2;;/p-2.
What are the key properties of bis(dihydrogen phosphate);nickel(2+)?
bis(dihydrogen phosphate);nickel(2+) has a molecular weight of 252.67 g/mol, XLogP of -3.12, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dihydrogen phosphate);nickel(2+) is sourced from PubChem (CID 14367986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).