azane;dihydrogen phosphate;hydron

H9N2O4P — CID 172995707

IUPACazane;dihydrogen phosphate;hydron
SMILESN.N.O=P([O-])(O)O.[H+]
InChIInChI=1S/2H3N.H3O4P/c;;1-5(2,3)4/h2*1H3;(H3,1,2,3,4)
InChIKeyMNNHAPBLZZVQHP-UHFFFAOYSA-N
MW132.06 g/mol
LogP-1.12
Rot. Bonds

About azane;dihydrogen phosphate;hydron

azane;dihydrogen phosphate;hydron (PubChem CID 172995707) has the molecular formula H9N2O4P and a molecular weight of 132.06 g/mol. Its IUPAC name is azane;dihydrogen phosphate;hydron.

Molecular Properties

Compound Nameazane;dihydrogen phosphate;hydron
PubChem CID172995707
Molecular FormulaH9N2O4P
Molecular Weight132.06 g/mol
Exact Mass132.03
IUPAC Nameazane;dihydrogen phosphate;hydron
SMILESN.N.O=P([O-])(O)O.[H+]
InChIInChI=1S/2H3N.H3O4P/c;;1-5(2,3)4/h2*1H3;(H3,1,2,3,4)
InChIKeyMNNHAPBLZZVQHP-UHFFFAOYSA-N
XLogP-1.12
TPSA150.59 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.06
LogP ≤ 5-1.12
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of azane;dihydrogen phosphate;hydron?
The IUPAC name of azane;dihydrogen phosphate;hydron (CID 172995707) is azane;dihydrogen phosphate;hydron.
What is the SMILES notation for azane;dihydrogen phosphate;hydron?
The canonical SMILES for azane;dihydrogen phosphate;hydron is N.N.O=P([O-])(O)O.[H+].
What is the InChIKey of azane;dihydrogen phosphate;hydron?
The InChIKey is MNNHAPBLZZVQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/2H3N.H3O4P/c;;1-5(2,3)4/h2*1H3;(H3,1,2,3,4).
What are the key properties of azane;dihydrogen phosphate;hydron?
azane;dihydrogen phosphate;hydron has a molecular weight of 132.06 g/mol, XLogP of -1.12, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;dihydrogen phosphate;hydron is sourced from PubChem (CID 172995707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).