azane;hydron;phosphate

H6NO4P — CID 173322696

IUPACazane;hydron;phosphate
SMILESN.O=P([O-])([O-])[O-].[H+].[H+].[H+]
InChIInChI=1S/H3N.H3O4P/c;1-5(2,3)4/h1H3;(H3,1,2,3,4)
InChIKeyLFVGISIMTYGQHF-UHFFFAOYSA-N
MW115.02 g/mol
LogP-2.33
Rot. Bonds

About azane;hydron;phosphate

azane;hydron;phosphate (PubChem CID 173322696) has the molecular formula H6NO4P and a molecular weight of 115.02 g/mol. Its IUPAC name is azane;hydron;phosphate.

Molecular Properties

Compound Nameazane;hydron;phosphate
PubChem CID173322696
Molecular FormulaH6NO4P
Molecular Weight115.02 g/mol
Exact Mass115.00
IUPAC Nameazane;hydron;phosphate
SMILESN.O=P([O-])([O-])[O-].[H+].[H+].[H+]
InChIInChI=1S/H3N.H3O4P/c;1-5(2,3)4/h1H3;(H3,1,2,3,4)
InChIKeyLFVGISIMTYGQHF-UHFFFAOYSA-N
XLogP-2.33
TPSA121.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.02
LogP ≤ 5-2.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

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CID 173494931
potassium;azane;hydron;phosphate
CID 173310600
hydron;phosphate
CID 19972274
azane;manganese(3+);phosphate
CID 174376080
hydron;iron(3+);phosphate
CID 173036063
hydron;zirconium;phosphate
CID 173215944
azane;cobalt(3+);phosphate
CID 3082159
zinc;hydron;diphosphate
CID 20841752
barium(2+);hydron;phosphate
CID 173013414
dipotassium;trisodium;hydron;triphosphate
CID 173105953
azane;iron(2+);manganese(2+);phosphate
CID 172802270
bis(gadolinium(3+)) diphosphate
CID 172754975

Frequently Asked Questions

What is the IUPAC name of azane;hydron;phosphate?
The IUPAC name of azane;hydron;phosphate (CID 173322696) is azane;hydron;phosphate.
What is the SMILES notation for azane;hydron;phosphate?
The canonical SMILES for azane;hydron;phosphate is N.O=P([O-])([O-])[O-].[H+].[H+].[H+].
What is the InChIKey of azane;hydron;phosphate?
The InChIKey is LFVGISIMTYGQHF-UHFFFAOYSA-N. The full InChI is InChI=1S/H3N.H3O4P/c;1-5(2,3)4/h1H3;(H3,1,2,3,4).
What are the key properties of azane;hydron;phosphate?
azane;hydron;phosphate has a molecular weight of 115.02 g/mol, XLogP of -2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;hydron;phosphate is sourced from PubChem (CID 173322696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).