trisodium;hydrogen peroxide;phosphate

H2Na3O6P — CID 161125728

IUPACtrisodium;hydrogen peroxide;phosphate
SMILESO=P([O-])([O-])[O-].OO.[Na+].[Na+].[Na+]
InChIInChI=1S/3Na.H3O4P.H2O2/c;;;1-5(2,3)4;1-2/h;;;(H3,1,2,3,4);1-2H/q3*+1;;/p-3
InChIKeyULNMAIWDPFNJAG-UHFFFAOYSA-K
MW197.95 g/mol
LogP-11.80
Rot. Bonds

About trisodium;hydrogen peroxide;phosphate

trisodium;hydrogen peroxide;phosphate (PubChem CID 161125728) has the molecular formula H2Na3O6P and a molecular weight of 197.95 g/mol. Its IUPAC name is trisodium;hydrogen peroxide;phosphate.

Molecular Properties

Compound Nametrisodium;hydrogen peroxide;phosphate
PubChem CID161125728
Molecular FormulaH2Na3O6P
Molecular Weight197.95 g/mol
Exact Mass197.93
IUPAC Nametrisodium;hydrogen peroxide;phosphate
SMILESO=P([O-])([O-])[O-].OO.[Na+].[Na+].[Na+]
InChIInChI=1S/3Na.H3O4P.H2O2/c;;;1-5(2,3)4;1-2/h;;;(H3,1,2,3,4);1-2H/q3*+1;;/p-3
InChIKeyULNMAIWDPFNJAG-UHFFFAOYSA-K
XLogP-11.80
TPSA126.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.95
LogP ≤ 5-11.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trisodium;hydrogen peroxide;phosphate?
The IUPAC name of trisodium;hydrogen peroxide;phosphate (CID 161125728) is trisodium;hydrogen peroxide;phosphate.
What is the SMILES notation for trisodium;hydrogen peroxide;phosphate?
The canonical SMILES for trisodium;hydrogen peroxide;phosphate is O=P([O-])([O-])[O-].OO.[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;hydrogen peroxide;phosphate?
The InChIKey is ULNMAIWDPFNJAG-UHFFFAOYSA-K. The full InChI is InChI=1S/3Na.H3O4P.H2O2/c;;;1-5(2,3)4;1-2/h;;;(H3,1,2,3,4);1-2H/q3*+1;;/p-3.
What are the key properties of trisodium;hydrogen peroxide;phosphate?
trisodium;hydrogen peroxide;phosphate has a molecular weight of 197.95 g/mol, XLogP of -11.80, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;hydrogen peroxide;phosphate is sourced from PubChem (CID 161125728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).