fluoro dihydrogen phosphate;iron

H2FFeO4P — CID 173042796

IUPACfluoro dihydrogen phosphate;iron
SMILESO=P(O)(O)OF.[Fe]
InChIInChI=1S/FH2O4P.Fe/c1-5-6(2,3)4;/h(H2,2,3,4);
InChIKeyXEBNCFKWEQHZGO-UHFFFAOYSA-N
MW171.83 g/mol
LogP-0.02
Rot. Bonds1

About fluoro dihydrogen phosphate;iron

fluoro dihydrogen phosphate;iron (PubChem CID 173042796) has the molecular formula H2FFeO4P and a molecular weight of 171.83 g/mol. Its IUPAC name is fluoro dihydrogen phosphate;iron.

Molecular Properties

Compound Namefluoro dihydrogen phosphate;iron
PubChem CID173042796
Molecular FormulaH2FFeO4P
Molecular Weight171.83 g/mol
Exact Mass171.90
IUPAC Namefluoro dihydrogen phosphate;iron
SMILESO=P(O)(O)OF.[Fe]
InChIInChI=1S/FH2O4P.Fe/c1-5-6(2,3)4;/h(H2,2,3,4);
InChIKeyXEBNCFKWEQHZGO-UHFFFAOYSA-N
XLogP-0.02
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.83
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

sodium;fluoro dihydrogen phosphate;hydride;iron
CID 173004802
fluoro dihydrogen phosphate;platinum
CID 174846501
calcium;fluoro dihydrogen phosphate;hydride
CID 174626748
ethene;fluoro dihydrogen phosphate
CID 87187087
calcium;magnesium;fluoro dihydrogen phosphate;hydride
CID 174988719
azane;fluoro dihydrogen phosphate;1,2,3,4,5,6-hexachlorocyclohexane
CID 87442574
chloro(fluorooxy)phosphinic acid;chlorophosphonic acid
CID 175540690
fluorooxy dihydrogen phosphate
CID 150692430
carbanylium;methyl dihydrogen phosphate
CID 165007935
iron;phosphoric acid
CID 174838016
iron;phosphoric acid
CID 175001141
fluoro methyl hydrogen phosphate
CID 87128109

Frequently Asked Questions

What is the IUPAC name of fluoro dihydrogen phosphate;iron?
The IUPAC name of fluoro dihydrogen phosphate;iron (CID 173042796) is fluoro dihydrogen phosphate;iron.
What is the SMILES notation for fluoro dihydrogen phosphate;iron?
The canonical SMILES for fluoro dihydrogen phosphate;iron is O=P(O)(O)OF.[Fe].
What is the InChIKey of fluoro dihydrogen phosphate;iron?
The InChIKey is XEBNCFKWEQHZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/FH2O4P.Fe/c1-5-6(2,3)4;/h(H2,2,3,4);.
What are the key properties of fluoro dihydrogen phosphate;iron?
fluoro dihydrogen phosphate;iron has a molecular weight of 171.83 g/mol, XLogP of -0.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro dihydrogen phosphate;iron is sourced from PubChem (CID 173042796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).