sodium;boric acid;hydride;tetrahydrate

H12BNaO7 — CID 173005468

IUPACsodium;boric acid;hydride;tetrahydrate
SMILESO.O.O.O.OB(O)O.[H-].[Na+]
InChIInChI=1S/BH3O3.Na.4H2O.H/c2-1(3)4;;;;;;/h2-4H;;4*1H2;/q;+1;;;;;-1
InChIKeyULLZWNUSPPOAKI-UHFFFAOYSA-N
MW157.89 g/mol
LogP-8.23
Rot. Bonds

About sodium;boric acid;hydride;tetrahydrate

sodium;boric acid;hydride;tetrahydrate (PubChem CID 173005468) has the molecular formula H12BNaO7 and a molecular weight of 157.89 g/mol. Its IUPAC name is sodium;boric acid;hydride;tetrahydrate.

Molecular Properties

Compound Namesodium;boric acid;hydride;tetrahydrate
PubChem CID173005468
Molecular FormulaH12BNaO7
Molecular Weight157.89 g/mol
Exact Mass158.06
IUPAC Namesodium;boric acid;hydride;tetrahydrate
SMILESO.O.O.O.OB(O)O.[H-].[Na+]
InChIInChI=1S/BH3O3.Na.4H2O.H/c2-1(3)4;;;;;;/h2-4H;;4*1H2;/q;+1;;;;;-1
InChIKeyULLZWNUSPPOAKI-UHFFFAOYSA-N
XLogP-8.23
TPSA186.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.89
LogP ≤ 5-8.23
H-Bond Donors ≤ 53
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 sodium;boric acid;hydride;tetrahydrate?
The IUPAC name of sodium;boric acid;hydride;tetrahydrate (CID 173005468) is sodium;boric acid;hydride;tetrahydrate.
What is the SMILES notation for sodium;boric acid;hydride;tetrahydrate?
The canonical SMILES for sodium;boric acid;hydride;tetrahydrate is O.O.O.O.OB(O)O.[H-].[Na+].
What is the InChIKey of sodium;boric acid;hydride;tetrahydrate?
The InChIKey is ULLZWNUSPPOAKI-UHFFFAOYSA-N. The full InChI is InChI=1S/BH3O3.Na.4H2O.H/c2-1(3)4;;;;;;/h2-4H;;4*1H2;/q;+1;;;;;-1.
What are the key properties of sodium;boric acid;hydride;tetrahydrate?
sodium;boric acid;hydride;tetrahydrate has a molecular weight of 157.89 g/mol, XLogP of -8.23, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;boric acid;hydride;tetrahydrate is sourced from PubChem (CID 173005468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).