zinc;dihydrogen borate;fluoride

H2BFO3Zn — CID 157330099

IUPACzinc;dihydrogen borate;fluoride
SMILES[F-].[O-]B(O)O.[Zn+2]
InChIInChI=1S/BH2O3.FH.Zn/c2-1(3)4;;/h2-3H;1H;/q-1;;+2/p-1
InChIKeyBFELZSCVNHGATL-UHFFFAOYSA-M
MW145.21 g/mol
LogP-5.68
Rot. Bonds

About zinc;dihydrogen borate;fluoride

zinc;dihydrogen borate;fluoride (PubChem CID 157330099) has the molecular formula H2BFO3Zn and a molecular weight of 145.21 g/mol. Its IUPAC name is zinc;dihydrogen borate;fluoride.

Molecular Properties

Compound Namezinc;dihydrogen borate;fluoride
PubChem CID157330099
Molecular FormulaH2BFO3Zn
Molecular Weight145.21 g/mol
Exact Mass143.94
IUPAC Namezinc;dihydrogen borate;fluoride
SMILES[F-].[O-]B(O)O.[Zn+2]
InChIInChI=1S/BH2O3.FH.Zn/c2-1(3)4;;/h2-3H;1H;/q-1;;+2/p-1
InChIKeyBFELZSCVNHGATL-UHFFFAOYSA-M
XLogP-5.68
TPSA63.52 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.21
LogP ≤ 5-5.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of zinc;dihydrogen borate;fluoride?
The IUPAC name of zinc;dihydrogen borate;fluoride (CID 157330099) is zinc;dihydrogen borate;fluoride.
What is the SMILES notation for zinc;dihydrogen borate;fluoride?
The canonical SMILES for zinc;dihydrogen borate;fluoride is [F-].[O-]B(O)O.[Zn+2].
What is the InChIKey of zinc;dihydrogen borate;fluoride?
The InChIKey is BFELZSCVNHGATL-UHFFFAOYSA-M. The full InChI is InChI=1S/BH2O3.FH.Zn/c2-1(3)4;;/h2-3H;1H;/q-1;;+2/p-1.
What are the key properties of zinc;dihydrogen borate;fluoride?
zinc;dihydrogen borate;fluoride has a molecular weight of 145.21 g/mol, XLogP of -5.68, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;dihydrogen borate;fluoride is sourced from PubChem (CID 157330099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).