sodium tetrahydroxyboranuide

H4BNaO4 — CID 23662119

IUPACsodium tetrahydroxyboranuide
SMILESO[B-](O)(O)O.[Na+]
InChIInChI=1S/BH4O4.Na/c2-1(3,4)5;/h2-5H;/q-1;+1
InChIKeySTVZSUXCUPXWTA-UHFFFAOYSA-N
MW101.83 g/mol
LogP-5.60
Rot. Bonds

About sodium tetrahydroxyboranuide

sodium tetrahydroxyboranuide (PubChem CID 23662119) has the molecular formula H4BNaO4 and a molecular weight of 101.83 g/mol. Its IUPAC name is sodium tetrahydroxyboranuide.

Molecular Properties

Compound Namesodium tetrahydroxyboranuide
PubChem CID23662119
Molecular FormulaH4BNaO4
Molecular Weight101.83 g/mol
Exact Mass102.01
IUPAC Namesodium tetrahydroxyboranuide
SMILESO[B-](O)(O)O.[Na+]
InChIInChI=1S/BH4O4.Na/c2-1(3,4)5;/h2-5H;/q-1;+1
InChIKeySTVZSUXCUPXWTA-UHFFFAOYSA-N
XLogP-5.60
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.83
LogP ≤ 5-5.60
H-Bond Donors ≤ 54
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 sodium tetrahydroxyboranuide?
The IUPAC name of sodium tetrahydroxyboranuide (CID 23662119) is sodium tetrahydroxyboranuide.
What is the SMILES notation for sodium tetrahydroxyboranuide?
The canonical SMILES for sodium tetrahydroxyboranuide is O[B-](O)(O)O.[Na+].
What is the InChIKey of sodium tetrahydroxyboranuide?
The InChIKey is STVZSUXCUPXWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/BH4O4.Na/c2-1(3,4)5;/h2-5H;/q-1;+1.
What are the key properties of sodium tetrahydroxyboranuide?
sodium tetrahydroxyboranuide has a molecular weight of 101.83 g/mol, XLogP of -5.60, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium tetrahydroxyboranuide is sourced from PubChem (CID 23662119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).