hydroxy(oxo)oxidanium

HO3+ — CID 6030661

IUPAChydroxy(oxo)oxidanium
SMILESO=[O+]O
InChIInChI=1S/HO3/c1-3-2/h1H/q+1
InChIKeyFQWSHTCXTQFHJZ-UHFFFAOYSA-N
MW49.01 g/mol
LogP0.08
Rot. Bonds

About hydroxy(oxo)oxidanium

hydroxy(oxo)oxidanium (PubChem CID 6030661) has the molecular formula HO3+ and a molecular weight of 49.01 g/mol. Its IUPAC name is hydroxy(oxo)oxidanium.

Molecular Properties

Compound Namehydroxy(oxo)oxidanium
PubChem CID6030661
Molecular FormulaHO3+
Molecular Weight49.01 g/mol
Exact Mass48.99
IUPAC Namehydroxy(oxo)oxidanium
SMILESO=[O+]O
InChIInChI=1S/HO3/c1-3-2/h1H/q+1
InChIKeyFQWSHTCXTQFHJZ-UHFFFAOYSA-N
XLogP0.08
TPSA48.60 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50049.01
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'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 hydroxy(oxo)oxidanium?
The IUPAC name of hydroxy(oxo)oxidanium (CID 6030661) is hydroxy(oxo)oxidanium.
What is the SMILES notation for hydroxy(oxo)oxidanium?
The canonical SMILES for hydroxy(oxo)oxidanium is O=[O+]O.
What is the InChIKey of hydroxy(oxo)oxidanium?
The InChIKey is FQWSHTCXTQFHJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/HO3/c1-3-2/h1H/q+1.
What are the key properties of hydroxy(oxo)oxidanium?
hydroxy(oxo)oxidanium has a molecular weight of 49.01 g/mol, XLogP of 0.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy(oxo)oxidanium is sourced from PubChem (CID 6030661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).