potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate

H5FeKO12P3 — CID 158840257

IUPACpotassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])(O)O.O=P([O-])([O-])[O-].[Fe+3].[K+]
InChIInChI=1S/Fe.K.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q+3;+1;;;/p-4
InChIKeyIYDNUXJTVPKXIQ-UHFFFAOYSA-J
MW384.89 g/mol
LogP-8.31
Rot. Bonds

About potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate

potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate (PubChem CID 158840257) has the molecular formula H5FeKO12P3 and a molecular weight of 384.89 g/mol. Its IUPAC name is potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate.

Molecular Properties

Compound Namepotassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate
PubChem CID158840257
Molecular FormulaH5FeKO12P3
Molecular Weight384.89 g/mol
Exact Mass384.80
IUPAC Namepotassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])(O)O.O=P([O-])([O-])[O-].[Fe+3].[K+]
InChIInChI=1S/Fe.K.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q+3;+1;;;/p-4
InChIKeyIYDNUXJTVPKXIQ-UHFFFAOYSA-J
XLogP-8.31
TPSA244.60 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.89
LogP ≤ 5-8.31
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate with MolForge

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

Launch Full Analysis

Related Compounds

dipotassium;bis(dihydrogen phosphate);phosphoric acid
CID 19756002
diazanium;potassium;phosphoric acid;phosphate
CID 172814489
potassium;disodium;dihydrogen phosphate;phosphoric acid;dihydroxide
CID 159576938
trisodium;phosphoric acid;phosphate
CID 172853200
trilithium;phosphoric acid;phosphate
CID 158468021
potassium;dihydrogen phosphate;hexahydrofluoride
CID 172717115
decaaluminum;phosphoric acid;decaphosphate
CID 173424288
triazanium;phosphoric acid;phosphate
CID 18943137
triacontacalcium;phosphoric acid;icosaphosphate
CID 173080509
calcium;magnesium;azane;dihydrogen phosphate;phosphoric acid;phosphate
CID 175409363
sodium;dihydrogen phosphate;phosphoric acid;dodecahydrate
CID 160530469
potassium;sodium;dihydrogen phosphate;chloride
CID 161315092

Frequently Asked Questions

What is the IUPAC name of potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate?
The IUPAC name of potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate (CID 158840257) is potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate.
What is the SMILES notation for potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate?
The canonical SMILES for potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate is O=P(O)(O)O.O=P([O-])(O)O.O=P([O-])([O-])[O-].[Fe+3].[K+].
What is the InChIKey of potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate?
The InChIKey is IYDNUXJTVPKXIQ-UHFFFAOYSA-J. The full InChI is InChI=1S/Fe.K.3H3O4P/c;;3*1-5(2,3)4/h;;3*(H3,1,2,3,4)/q+3;+1;;;/p-4.
What are the key properties of potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate?
potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate has a molecular weight of 384.89 g/mol, XLogP of -8.31, 0 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;dihydrogen phosphate;iron(3+);phosphoric acid;phosphate is sourced from PubChem (CID 158840257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).