azanium;hydroxyazanium;sulfate

H8N2O5S — CID 23041852

IUPACazanium;hydroxyazanium;sulfate
SMILESO=S(=O)([O-])[O-].[NH3+]O.[NH4+]
InChIInChI=1S/H4NO.H3N.H2O4S/c1-2;;1-5(2,3)4/h2H,1H3;1H3;(H2,1,2,3,4)/q+1;;/p-1
InChIKeyVRTBIZHGOJMOED-UHFFFAOYSA-M
MW148.14 g/mol
LogP-2.34
Rot. Bonds

About azanium;hydroxyazanium;sulfate

azanium;hydroxyazanium;sulfate (PubChem CID 23041852) has the molecular formula H8N2O5S and a molecular weight of 148.14 g/mol. Its IUPAC name is azanium;hydroxyazanium;sulfate.

Molecular Properties

Compound Nameazanium;hydroxyazanium;sulfate
PubChem CID23041852
Molecular FormulaH8N2O5S
Molecular Weight148.14 g/mol
Exact Mass148.02
IUPAC Nameazanium;hydroxyazanium;sulfate
SMILESO=S(=O)([O-])[O-].[NH3+]O.[NH4+]
InChIInChI=1S/H4NO.H3N.H2O4S/c1-2;;1-5(2,3)4/h2H,1H3;1H3;(H2,1,2,3,4)/q+1;;/p-1
InChIKeyVRTBIZHGOJMOED-UHFFFAOYSA-M
XLogP-2.34
TPSA164.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 5-2.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of azanium;hydroxyazanium;sulfate?
The IUPAC name of azanium;hydroxyazanium;sulfate (CID 23041852) is azanium;hydroxyazanium;sulfate.
What is the SMILES notation for azanium;hydroxyazanium;sulfate?
The canonical SMILES for azanium;hydroxyazanium;sulfate is O=S(=O)([O-])[O-].[NH3+]O.[NH4+].
What is the InChIKey of azanium;hydroxyazanium;sulfate?
The InChIKey is VRTBIZHGOJMOED-UHFFFAOYSA-M. The full InChI is InChI=1S/H4NO.H3N.H2O4S/c1-2;;1-5(2,3)4/h2H,1H3;1H3;(H2,1,2,3,4)/q+1;;/p-1.
What are the key properties of azanium;hydroxyazanium;sulfate?
azanium;hydroxyazanium;sulfate has a molecular weight of 148.14 g/mol, XLogP of -2.34, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;hydroxyazanium;sulfate is sourced from PubChem (CID 23041852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).