azanium;lanthanum(3+);disulfate

H4LaNO8S2 — CID 56843854

IUPACazanium;lanthanum(3+);disulfate
SMILESO=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[La+3].[NH4+]
InChIInChI=1S/La.H3N.2H2O4S/c;;2*1-5(2,3)4/h;1H3;2*(H2,1,2,3,4)/q+3;;;/p-3
InChIKeyZTSZHNPFZDMIFW-UHFFFAOYSA-K
MW349.07 g/mol
LogP-2.30
Rot. Bonds

About azanium;lanthanum(3+);disulfate

azanium;lanthanum(3+);disulfate (PubChem CID 56843854) has the molecular formula H4LaNO8S2 and a molecular weight of 349.07 g/mol. Its IUPAC name is azanium;lanthanum(3+);disulfate.

Molecular Properties

Compound Nameazanium;lanthanum(3+);disulfate
PubChem CID56843854
Molecular FormulaH4LaNO8S2
Molecular Weight349.07 g/mol
Exact Mass348.84
IUPAC Nameazanium;lanthanum(3+);disulfate
SMILESO=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[La+3].[NH4+]
InChIInChI=1S/La.H3N.2H2O4S/c;;2*1-5(2,3)4/h;1H3;2*(H2,1,2,3,4)/q+3;;;/p-3
InChIKeyZTSZHNPFZDMIFW-UHFFFAOYSA-K
XLogP-2.30
TPSA197.02 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.07
LogP ≤ 5-2.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'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;lanthanum(3+);disulfate?
The IUPAC name of azanium;lanthanum(3+);disulfate (CID 56843854) is azanium;lanthanum(3+);disulfate.
What is the SMILES notation for azanium;lanthanum(3+);disulfate?
The canonical SMILES for azanium;lanthanum(3+);disulfate is O=S(=O)([O-])[O-].O=S(=O)([O-])[O-].[La+3].[NH4+].
What is the InChIKey of azanium;lanthanum(3+);disulfate?
The InChIKey is ZTSZHNPFZDMIFW-UHFFFAOYSA-K. The full InChI is InChI=1S/La.H3N.2H2O4S/c;;2*1-5(2,3)4/h;1H3;2*(H2,1,2,3,4)/q+3;;;/p-3.
What are the key properties of azanium;lanthanum(3+);disulfate?
azanium;lanthanum(3+);disulfate has a molecular weight of 349.07 g/mol, XLogP of -2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;lanthanum(3+);disulfate is sourced from PubChem (CID 56843854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).