sodium;boranuide;hydrogen peroxide

H6BNaO2 — CID 174650986

IUPACsodium;boranuide;hydrogen peroxide
SMILESOO.[BH4-].[Na+]
InChIInChI=1S/BH4.Na.H2O2/c;;1-2/h1H4;;1-2H/q-1;+1;
InChIKeyDSSRIBAXZYOBFQ-UHFFFAOYSA-N
MW71.85 g/mol
LogP-4.43
Rot. Bonds

About sodium;boranuide;hydrogen peroxide

sodium;boranuide;hydrogen peroxide (PubChem CID 174650986) has the molecular formula H6BNaO2 and a molecular weight of 71.85 g/mol. Its IUPAC name is sodium;boranuide;hydrogen peroxide.

Molecular Properties

Compound Namesodium;boranuide;hydrogen peroxide
PubChem CID174650986
Molecular FormulaH6BNaO2
Molecular Weight71.85 g/mol
Exact Mass72.04
IUPAC Namesodium;boranuide;hydrogen peroxide
SMILESOO.[BH4-].[Na+]
InChIInChI=1S/BH4.Na.H2O2/c;;1-2/h1H4;;1-2H/q-1;+1;
InChIKeyDSSRIBAXZYOBFQ-UHFFFAOYSA-N
XLogP-4.43
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50071.85
LogP ≤ 5-4.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

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CID 173123263

Frequently Asked Questions

What is the IUPAC name of sodium;boranuide;hydrogen peroxide?
The IUPAC name of sodium;boranuide;hydrogen peroxide (CID 174650986) is sodium;boranuide;hydrogen peroxide.
What is the SMILES notation for sodium;boranuide;hydrogen peroxide?
The canonical SMILES for sodium;boranuide;hydrogen peroxide is OO.[BH4-].[Na+].
What is the InChIKey of sodium;boranuide;hydrogen peroxide?
The InChIKey is DSSRIBAXZYOBFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/BH4.Na.H2O2/c;;1-2/h1H4;;1-2H/q-1;+1;.
What are the key properties of sodium;boranuide;hydrogen peroxide?
sodium;boranuide;hydrogen peroxide has a molecular weight of 71.85 g/mol, XLogP of -4.43, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;boranuide;hydrogen peroxide is sourced from PubChem (CID 174650986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).