zinc;dihydrogen borate;hydroxide

H3BO4Zn — CID 159310168

IUPACzinc;dihydrogen borate;hydroxide
SMILES[O-]B(O)O.[OH-].[Zn+2]
InChIInChI=1S/BH2O3.H2O.Zn/c2-1(3)4;;/h2-3H;1H2;/q-1;;+2/p-1
InChIKeyLCKXJTKMQHJMLY-UHFFFAOYSA-M
MW143.22 g/mol
LogP-2.86
Rot. Bonds

About zinc;dihydrogen borate;hydroxide

zinc;dihydrogen borate;hydroxide (PubChem CID 159310168) has the molecular formula H3BO4Zn and a molecular weight of 143.22 g/mol. Its IUPAC name is zinc;dihydrogen borate;hydroxide.

Molecular Properties

Compound Namezinc;dihydrogen borate;hydroxide
PubChem CID159310168
Molecular FormulaH3BO4Zn
Molecular Weight143.22 g/mol
Exact Mass141.94
IUPAC Namezinc;dihydrogen borate;hydroxide
SMILES[O-]B(O)O.[OH-].[Zn+2]
InChIInChI=1S/BH2O3.H2O.Zn/c2-1(3)4;;/h2-3H;1H2;/q-1;;+2/p-1
InChIKeyLCKXJTKMQHJMLY-UHFFFAOYSA-M
XLogP-2.86
TPSA93.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.22
LogP ≤ 5-2.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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;hydroxide?
The IUPAC name of zinc;dihydrogen borate;hydroxide (CID 159310168) is zinc;dihydrogen borate;hydroxide.
What is the SMILES notation for zinc;dihydrogen borate;hydroxide?
The canonical SMILES for zinc;dihydrogen borate;hydroxide is [O-]B(O)O.[OH-].[Zn+2].
What is the InChIKey of zinc;dihydrogen borate;hydroxide?
The InChIKey is LCKXJTKMQHJMLY-UHFFFAOYSA-M. The full InChI is InChI=1S/BH2O3.H2O.Zn/c2-1(3)4;;/h2-3H;1H2;/q-1;;+2/p-1.
What are the key properties of zinc;dihydrogen borate;hydroxide?
zinc;dihydrogen borate;hydroxide has a molecular weight of 143.22 g/mol, XLogP of -2.86, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;dihydrogen borate;hydroxide is sourced from PubChem (CID 159310168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).