magnesium;azane;hydrogen phosphate;dihydrate

H11MgN2O6P — CID 174898983

IUPACmagnesium;azane;hydrogen phosphate;dihydrate
SMILESN.N.O.O.O=P([O-])([O-])O.[Mg+2]
InChIInChI=1S/Mg.2H3N.H3O4P.2H2O/c;;;1-5(2,3)4;;/h;2*1H3;(H3,1,2,3,4);2*1H2/q+2;;;;;/p-2
InChIKeyBJKCYMICTRJUBM-UHFFFAOYSA-L
MW190.37 g/mol
LogP-3.90
Rot. Bonds

About magnesium;azane;hydrogen phosphate;dihydrate

magnesium;azane;hydrogen phosphate;dihydrate (PubChem CID 174898983) has the molecular formula H11MgN2O6P and a molecular weight of 190.37 g/mol. Its IUPAC name is magnesium;azane;hydrogen phosphate;dihydrate.

Molecular Properties

Compound Namemagnesium;azane;hydrogen phosphate;dihydrate
PubChem CID174898983
Molecular FormulaH11MgN2O6P
Molecular Weight190.37 g/mol
Exact Mass190.02
IUPAC Namemagnesium;azane;hydrogen phosphate;dihydrate
SMILESN.N.O.O.O=P([O-])([O-])O.[Mg+2]
InChIInChI=1S/Mg.2H3N.H3O4P.2H2O/c;;;1-5(2,3)4;;/h;2*1H3;(H3,1,2,3,4);2*1H2/q+2;;;;;/p-2
InChIKeyBJKCYMICTRJUBM-UHFFFAOYSA-L
XLogP-3.90
TPSA216.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.37
LogP ≤ 5-3.90
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of magnesium;azane;hydrogen phosphate;dihydrate?
The IUPAC name of magnesium;azane;hydrogen phosphate;dihydrate (CID 174898983) is magnesium;azane;hydrogen phosphate;dihydrate.
What is the SMILES notation for magnesium;azane;hydrogen phosphate;dihydrate?
The canonical SMILES for magnesium;azane;hydrogen phosphate;dihydrate is N.N.O.O.O=P([O-])([O-])O.[Mg+2].
What is the InChIKey of magnesium;azane;hydrogen phosphate;dihydrate?
The InChIKey is BJKCYMICTRJUBM-UHFFFAOYSA-L. The full InChI is InChI=1S/Mg.2H3N.H3O4P.2H2O/c;;;1-5(2,3)4;;/h;2*1H3;(H3,1,2,3,4);2*1H2/q+2;;;;;/p-2.
What are the key properties of magnesium;azane;hydrogen phosphate;dihydrate?
magnesium;azane;hydrogen phosphate;dihydrate has a molecular weight of 190.37 g/mol, XLogP of -3.90, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;azane;hydrogen phosphate;dihydrate is sourced from PubChem (CID 174898983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).