diazanium;oxido hydrogen phosphate

H9N2O5P — CID 11491954

IUPACdiazanium;oxido hydrogen phosphate
SMILESO=P([O-])(O)O[O-].[NH4+].[NH4+]
InChIInChI=1S/2H3N.H3O5P/c;;1-5-6(2,3)4/h2*1H3;1H,(H2,2,3,4)
InChIKeyWAWSKSCHWRYHLE-UHFFFAOYSA-N
MW148.06 g/mol
LogP-1.51
Rot. Bonds1

About diazanium;oxido hydrogen phosphate

diazanium;oxido hydrogen phosphate (PubChem CID 11491954) has the molecular formula H9N2O5P and a molecular weight of 148.06 g/mol. Its IUPAC name is diazanium;oxido hydrogen phosphate.

Molecular Properties

Compound Namediazanium;oxido hydrogen phosphate
PubChem CID11491954
Molecular FormulaH9N2O5P
Molecular Weight148.06 g/mol
Exact Mass148.02
IUPAC Namediazanium;oxido hydrogen phosphate
SMILESO=P([O-])(O)O[O-].[NH4+].[NH4+]
InChIInChI=1S/2H3N.H3O5P/c;;1-5-6(2,3)4/h2*1H3;1H,(H2,2,3,4)
InChIKeyWAWSKSCHWRYHLE-UHFFFAOYSA-N
XLogP-1.51
TPSA165.65 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.06
LogP ≤ 5-1.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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CID 22328152

Frequently Asked Questions

What is the IUPAC name of diazanium;oxido hydrogen phosphate?
The IUPAC name of diazanium;oxido hydrogen phosphate (CID 11491954) is diazanium;oxido hydrogen phosphate.
What is the SMILES notation for diazanium;oxido hydrogen phosphate?
The canonical SMILES for diazanium;oxido hydrogen phosphate is O=P([O-])(O)O[O-].[NH4+].[NH4+].
What is the InChIKey of diazanium;oxido hydrogen phosphate?
The InChIKey is WAWSKSCHWRYHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/2H3N.H3O5P/c;;1-5-6(2,3)4/h2*1H3;1H,(H2,2,3,4).
What are the key properties of diazanium;oxido hydrogen phosphate?
diazanium;oxido hydrogen phosphate has a molecular weight of 148.06 g/mol, XLogP of -1.51, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diazanium;oxido hydrogen phosphate is sourced from PubChem (CID 11491954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).