sodium;hydrogen peroxide;hypochlorite;hydrochloride

H3Cl2NaO3 — CID 159585229

IUPACsodium;hydrogen peroxide;hypochlorite;hydrochloride
SMILESCl.OO.[Na+].[O-]Cl
InChIInChI=1S/ClO.ClH.Na.H2O2/c1-2;;;1-2/h;1H;;1-2H/q-1;;+1;
InChIKeyUYKBMNSRYDUJHJ-UHFFFAOYSA-N
MW144.92 g/mol
LogP-3.06
Rot. Bonds

About sodium;hydrogen peroxide;hypochlorite;hydrochloride

sodium;hydrogen peroxide;hypochlorite;hydrochloride (PubChem CID 159585229) has the molecular formula H3Cl2NaO3 and a molecular weight of 144.92 g/mol. Its IUPAC name is sodium;hydrogen peroxide;hypochlorite;hydrochloride.

Molecular Properties

Compound Namesodium;hydrogen peroxide;hypochlorite;hydrochloride
PubChem CID159585229
Molecular FormulaH3Cl2NaO3
Molecular Weight144.92 g/mol
Exact Mass143.94
IUPAC Namesodium;hydrogen peroxide;hypochlorite;hydrochloride
SMILESCl.OO.[Na+].[O-]Cl
InChIInChI=1S/ClO.ClH.Na.H2O2/c1-2;;;1-2/h;1H;;1-2H/q-1;;+1;
InChIKeyUYKBMNSRYDUJHJ-UHFFFAOYSA-N
XLogP-3.06
TPSA63.52 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.92
LogP ≤ 5-3.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;hydrogen peroxide;hypochlorite;hydrochloride?
The IUPAC name of sodium;hydrogen peroxide;hypochlorite;hydrochloride (CID 159585229) is sodium;hydrogen peroxide;hypochlorite;hydrochloride.
What is the SMILES notation for sodium;hydrogen peroxide;hypochlorite;hydrochloride?
The canonical SMILES for sodium;hydrogen peroxide;hypochlorite;hydrochloride is Cl.OO.[Na+].[O-]Cl.
What is the InChIKey of sodium;hydrogen peroxide;hypochlorite;hydrochloride?
The InChIKey is UYKBMNSRYDUJHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/ClO.ClH.Na.H2O2/c1-2;;;1-2/h;1H;;1-2H/q-1;;+1;.
What are the key properties of sodium;hydrogen peroxide;hypochlorite;hydrochloride?
sodium;hydrogen peroxide;hypochlorite;hydrochloride has a molecular weight of 144.92 g/mol, XLogP of -3.06, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydrogen peroxide;hypochlorite;hydrochloride is sourced from PubChem (CID 159585229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).