fluoroboronic acid;dihydroiodide

H4BFI2O2 — CID 173365559

IUPACfluoroboronic acid;dihydroiodide
SMILESI.I.OB(O)F
InChIInChI=1S/BFH2O2.2HI/c2-1(3)4;;/h3-4H;2*1H
InChIKeyBPBAFLSXHGPDCG-UHFFFAOYSA-N
MW319.65 g/mol
LogP0.16
Rot. Bonds

About fluoroboronic acid;dihydroiodide

fluoroboronic acid;dihydroiodide (PubChem CID 173365559) has the molecular formula H4BFI2O2 and a molecular weight of 319.65 g/mol. Its IUPAC name is fluoroboronic acid;dihydroiodide.

Molecular Properties

Compound Namefluoroboronic acid;dihydroiodide
PubChem CID173365559
Molecular FormulaH4BFI2O2
Molecular Weight319.65 g/mol
Exact Mass319.84
IUPAC Namefluoroboronic acid;dihydroiodide
SMILESI.I.OB(O)F
InChIInChI=1S/BFH2O2.2HI/c2-1(3)4;;/h3-4H;2*1H
InChIKeyBPBAFLSXHGPDCG-UHFFFAOYSA-N
XLogP0.16
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.65
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of fluoroboronic acid;dihydroiodide?
The IUPAC name of fluoroboronic acid;dihydroiodide (CID 173365559) is fluoroboronic acid;dihydroiodide.
What is the SMILES notation for fluoroboronic acid;dihydroiodide?
The canonical SMILES for fluoroboronic acid;dihydroiodide is I.I.OB(O)F.
What is the InChIKey of fluoroboronic acid;dihydroiodide?
The InChIKey is BPBAFLSXHGPDCG-UHFFFAOYSA-N. The full InChI is InChI=1S/BFH2O2.2HI/c2-1(3)4;;/h3-4H;2*1H.
What are the key properties of fluoroboronic acid;dihydroiodide?
fluoroboronic acid;dihydroiodide has a molecular weight of 319.65 g/mol, XLogP of 0.16, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroboronic acid;dihydroiodide is sourced from PubChem (CID 173365559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).