pentapotassium;phosphonato phosphate

K5O7P2+ — CID 160513555

IUPACpentapotassium;phosphonato phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/5K.H4O7P2/c;;;;;1-8(2,3)7-9(4,5)6/h;;;;;(H2,1,2,3)(H2,4,5,6)/q5*+1;/p-4
InChIKeyQTIUYGJJIHKTGF-UHFFFAOYSA-J
MW369.43 g/mol
LogP-18.32
Rot. Bonds2

About pentapotassium;phosphonato phosphate

pentapotassium;phosphonato phosphate (PubChem CID 160513555) has the molecular formula K5O7P2+ and a molecular weight of 369.43 g/mol. Its IUPAC name is pentapotassium;phosphonato phosphate.

Molecular Properties

Compound Namepentapotassium;phosphonato phosphate
PubChem CID160513555
Molecular FormulaK5O7P2+
Molecular Weight369.43 g/mol
Exact Mass368.73
IUPAC Namepentapotassium;phosphonato phosphate
SMILESO=P([O-])([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/5K.H4O7P2/c;;;;;1-8(2,3)7-9(4,5)6/h;;;;;(H2,1,2,3)(H2,4,5,6)/q5*+1;/p-4
InChIKeyQTIUYGJJIHKTGF-UHFFFAOYSA-J
XLogP-18.32
TPSA135.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 5-18.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze pentapotassium;phosphonato phosphate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of pentapotassium;phosphonato phosphate?
The IUPAC name of pentapotassium;phosphonato phosphate (CID 160513555) is pentapotassium;phosphonato phosphate.
What is the SMILES notation for pentapotassium;phosphonato phosphate?
The canonical SMILES for pentapotassium;phosphonato phosphate is O=P([O-])([O-])OP(=O)([O-])[O-].[K+].[K+].[K+].[K+].[K+].
What is the InChIKey of pentapotassium;phosphonato phosphate?
The InChIKey is QTIUYGJJIHKTGF-UHFFFAOYSA-J. The full InChI is InChI=1S/5K.H4O7P2/c;;;;;1-8(2,3)7-9(4,5)6/h;;;;;(H2,1,2,3)(H2,4,5,6)/q5*+1;/p-4.
What are the key properties of pentapotassium;phosphonato phosphate?
pentapotassium;phosphonato phosphate has a molecular weight of 369.43 g/mol, XLogP of -18.32, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for pentapotassium;phosphonato phosphate is sourced from PubChem (CID 160513555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).