azanium oxido chlorate

H4ClNO4 — CID 10219415

IUPACazanium oxido chlorate
SMILES[NH4+].[O-]O[Cl+2]([O-])[O-]
InChIInChI=1S/ClHO4.H3N/c2-1(3)5-4;/h4H;1H3
InChIKeyMPIOREYOLNPVGZ-UHFFFAOYSA-N
MW117.49 g/mol
LogP-3.26
Rot. Bonds1

About azanium oxido chlorate

azanium oxido chlorate (PubChem CID 10219415) has the molecular formula H4ClNO4 and a molecular weight of 117.49 g/mol. Its IUPAC name is azanium oxido chlorate.

Molecular Properties

Compound Nameazanium oxido chlorate
PubChem CID10219415
Molecular FormulaH4ClNO4
Molecular Weight117.49 g/mol
Exact Mass116.98
IUPAC Nameazanium oxido chlorate
SMILES[NH4+].[O-]O[Cl+2]([O-])[O-]
InChIInChI=1S/ClHO4.H3N/c2-1(3)5-4;/h4H;1H3
InChIKeyMPIOREYOLNPVGZ-UHFFFAOYSA-N
XLogP-3.26
TPSA114.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.49
LogP ≤ 5-3.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 azanium oxido chlorate?
The IUPAC name of azanium oxido chlorate (CID 10219415) is azanium oxido chlorate.
What is the SMILES notation for azanium oxido chlorate?
The canonical SMILES for azanium oxido chlorate is [NH4+].[O-]O[Cl+2]([O-])[O-].
What is the InChIKey of azanium oxido chlorate?
The InChIKey is MPIOREYOLNPVGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/ClHO4.H3N/c2-1(3)5-4;/h4H;1H3.
What are the key properties of azanium oxido chlorate?
azanium oxido chlorate has a molecular weight of 117.49 g/mol, XLogP of -3.26, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azanium oxido chlorate is sourced from PubChem (CID 10219415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).