azanium;cerium(3+);sulfate;hydrate

H6CeNO5S+2 — CID 19882911

IUPACazanium;cerium(3+);sulfate;hydrate
SMILESO.O=S(=O)([O-])[O-].[Ce+3].[NH4+]
InChIInChI=1S/Ce.H3N.H2O4S.H2O/c;;1-5(2,3)4;/h;1H3;(H2,1,2,3,4);1H2/q+3;;;/p-1
InChIKeyXCRNZTRYCDTNFG-UHFFFAOYSA-M
MW272.23 g/mol
LogP-1.79
Rot. Bonds

About azanium;cerium(3+);sulfate;hydrate

azanium;cerium(3+);sulfate;hydrate (PubChem CID 19882911) has the molecular formula H6CeNO5S+2 and a molecular weight of 272.23 g/mol. Its IUPAC name is azanium;cerium(3+);sulfate;hydrate.

Molecular Properties

Compound Nameazanium;cerium(3+);sulfate;hydrate
PubChem CID19882911
Molecular FormulaH6CeNO5S+2
Molecular Weight272.23 g/mol
Exact Mass271.90
IUPAC Nameazanium;cerium(3+);sulfate;hydrate
SMILESO.O=S(=O)([O-])[O-].[Ce+3].[NH4+]
InChIInChI=1S/Ce.H3N.H2O4S.H2O/c;;1-5(2,3)4;/h;1H3;(H2,1,2,3,4);1H2/q+3;;;/p-1
InChIKeyXCRNZTRYCDTNFG-UHFFFAOYSA-M
XLogP-1.79
TPSA148.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.23
LogP ≤ 5-1.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

azanium;cerium(3+);disulfate;hydrate
CID 91824227
bis(cerium(3+));trisulfate;pentahydrate
CID 57370410
diazanium;bis(chromium(3+));tetrasulfate;tetracosahydrate
CID 135395391
octaazanium;tetrasulfate
CID 86742620
azanium sulfate
CID 21225610
sulfate trihydrate
CID 22613957
azanium;lithium;sulfate
CID 139045804
diazanium;hydrazine;sulfate;hydrate
CID 159722336
disodium;disulfate;hydrate
CID 20976610
dialuminum;trisulfate;tetrahydrate
CID 169423459
copper;disulfate;hydrate
CID 44601134
bis(neodymium(3+));trisulfate;hydrate
CID 53249209

Frequently Asked Questions

What is the IUPAC name of azanium;cerium(3+);sulfate;hydrate?
The IUPAC name of azanium;cerium(3+);sulfate;hydrate (CID 19882911) is azanium;cerium(3+);sulfate;hydrate.
What is the SMILES notation for azanium;cerium(3+);sulfate;hydrate?
The canonical SMILES for azanium;cerium(3+);sulfate;hydrate is O.O=S(=O)([O-])[O-].[Ce+3].[NH4+].
What is the InChIKey of azanium;cerium(3+);sulfate;hydrate?
The InChIKey is XCRNZTRYCDTNFG-UHFFFAOYSA-M. The full InChI is InChI=1S/Ce.H3N.H2O4S.H2O/c;;1-5(2,3)4;/h;1H3;(H2,1,2,3,4);1H2/q+3;;;/p-1.
What are the key properties of azanium;cerium(3+);sulfate;hydrate?
azanium;cerium(3+);sulfate;hydrate has a molecular weight of 272.23 g/mol, XLogP of -1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;cerium(3+);sulfate;hydrate is sourced from PubChem (CID 19882911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).