diazanium;arsorate

H8AsN2O4- — CID 23618854

IUPACdiazanium;arsorate
SMILESO=[As]([O-])([O-])[O-].[NH4+].[NH4+]
InChIInChI=1S/AsH3O4.2H3N/c2-1(3,4)5;;/h(H3,2,3,4,5);2*1H3/p-1
InChIKeyXPVHUBFHKQQSDA-UHFFFAOYSA-M
MW175.00 g/mol
LogP-3.31
Rot. Bonds

About diazanium;arsorate

diazanium;arsorate (PubChem CID 23618854) has the molecular formula H8AsN2O4- and a molecular weight of 175.00 g/mol. Its IUPAC name is diazanium;arsorate.

Molecular Properties

Compound Namediazanium;arsorate
PubChem CID23618854
Molecular FormulaH8AsN2O4-
Molecular Weight175.00 g/mol
Exact Mass174.97
IUPAC Namediazanium;arsorate
SMILESO=[As]([O-])([O-])[O-].[NH4+].[NH4+]
InChIInChI=1S/AsH3O4.2H3N/c2-1(3,4)5;;/h(H3,2,3,4,5);2*1H3/p-1
InChIKeyXPVHUBFHKQQSDA-UHFFFAOYSA-M
XLogP-3.31
TPSA159.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.00
LogP ≤ 5-3.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diazanium;arsorate?
The IUPAC name of diazanium;arsorate (CID 23618854) is diazanium;arsorate.
What is the SMILES notation for diazanium;arsorate?
The canonical SMILES for diazanium;arsorate is O=[As]([O-])([O-])[O-].[NH4+].[NH4+].
What is the InChIKey of diazanium;arsorate?
The InChIKey is XPVHUBFHKQQSDA-UHFFFAOYSA-M. The full InChI is InChI=1S/AsH3O4.2H3N/c2-1(3,4)5;;/h(H3,2,3,4,5);2*1H3/p-1.
What are the key properties of diazanium;arsorate?
diazanium;arsorate has a molecular weight of 175.00 g/mol, XLogP of -3.31, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diazanium;arsorate is sourced from PubChem (CID 23618854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).