fluorooxy dihydrogen phosphate

H2FO5P — CID 150692430

IUPACfluorooxy dihydrogen phosphate
SMILESO=P(O)(O)OOF
InChIInChI=1S/FH2O5P/c1-5-6-7(2,3)4/h(H2,2,3,4)
InChIKeyJKDWAFHQHUBKNY-UHFFFAOYSA-N
MW131.98 g/mol
LogP-0.09
Rot. Bonds2

About fluorooxy dihydrogen phosphate

fluorooxy dihydrogen phosphate (PubChem CID 150692430) has the molecular formula H2FO5P and a molecular weight of 131.98 g/mol. Its IUPAC name is fluorooxy dihydrogen phosphate.

Molecular Properties

Compound Namefluorooxy dihydrogen phosphate
PubChem CID150692430
Molecular FormulaH2FO5P
Molecular Weight131.98 g/mol
Exact Mass131.96
IUPAC Namefluorooxy dihydrogen phosphate
SMILESO=P(O)(O)OOF
InChIInChI=1S/FH2O5P/c1-5-6-7(2,3)4/h(H2,2,3,4)
InChIKeyJKDWAFHQHUBKNY-UHFFFAOYSA-N
XLogP-0.09
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.98
LogP ≤ 5-0.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Related Compounds

fluoro dihydrogen phosphate;iron
CID 173042796
fluoro dihydrogen phosphate;platinum
CID 174846501
tetrasodium;hydride;phosphonooxy dihydrogen phosphate
CID 173345146
calcium;fluoro dihydrogen phosphate;hydride
CID 174626748
ethene;fluoro dihydrogen phosphate
CID 87187087
sodium;fluoro dihydrogen phosphate;hydride;iron
CID 173004802
calcium;magnesium;fluoro dihydrogen phosphate;hydride
CID 174988719
azane;fluoro dihydrogen phosphate;1,2,3,4,5,6-hexachlorocyclohexane
CID 87442574
sodium phosphonooxy hydrogen phosphate
CID 159276907
phosphoric acid;trihydroxysilyl hypofluorite
CID 173286464
1,1-difluoroethylphosphonic acid
CID 23183684
sulfooxy dihydrogen phosphate
CID 20982148

Frequently Asked Questions

What is the IUPAC name of fluorooxy dihydrogen phosphate?
The IUPAC name of fluorooxy dihydrogen phosphate (CID 150692430) is fluorooxy dihydrogen phosphate.
What is the SMILES notation for fluorooxy dihydrogen phosphate?
The canonical SMILES for fluorooxy dihydrogen phosphate is O=P(O)(O)OOF.
What is the InChIKey of fluorooxy dihydrogen phosphate?
The InChIKey is JKDWAFHQHUBKNY-UHFFFAOYSA-N. The full InChI is InChI=1S/FH2O5P/c1-5-6-7(2,3)4/h(H2,2,3,4).
What are the key properties of fluorooxy dihydrogen phosphate?
fluorooxy dihydrogen phosphate has a molecular weight of 131.98 g/mol, XLogP of -0.09, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for fluorooxy dihydrogen phosphate is sourced from PubChem (CID 150692430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).