sodium;dihydrogen phosphite;hydrate

H4NaO4P — CID 162185161

IUPACsodium;dihydrogen phosphite;hydrate
SMILESO.[Na+].[O-]P(O)O
InChIInChI=1S/Na.H2O3P.H2O/c;1-4(2)3;/h;1-2H;1H2/q+1;-1;
InChIKeyZPOHATURJPDCDL-UHFFFAOYSA-N
MW121.99 g/mol
LogP-5.26
Rot. Bonds

About sodium;dihydrogen phosphite;hydrate

sodium;dihydrogen phosphite;hydrate (PubChem CID 162185161) has the molecular formula H4NaO4P and a molecular weight of 121.99 g/mol. Its IUPAC name is sodium;dihydrogen phosphite;hydrate.

Molecular Properties

Compound Namesodium;dihydrogen phosphite;hydrate
PubChem CID162185161
Molecular FormulaH4NaO4P
Molecular Weight121.99 g/mol
Exact Mass121.97
IUPAC Namesodium;dihydrogen phosphite;hydrate
SMILESO.[Na+].[O-]P(O)O
InChIInChI=1S/Na.H2O3P.H2O/c;1-4(2)3;/h;1-2H;1H2/q+1;-1;
InChIKeyZPOHATURJPDCDL-UHFFFAOYSA-N
XLogP-5.26
TPSA95.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.99
LogP ≤ 5-5.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;dihydrogen phosphite;hydrate?
The IUPAC name of sodium;dihydrogen phosphite;hydrate (CID 162185161) is sodium;dihydrogen phosphite;hydrate.
What is the SMILES notation for sodium;dihydrogen phosphite;hydrate?
The canonical SMILES for sodium;dihydrogen phosphite;hydrate is O.[Na+].[O-]P(O)O.
What is the InChIKey of sodium;dihydrogen phosphite;hydrate?
The InChIKey is ZPOHATURJPDCDL-UHFFFAOYSA-N. The full InChI is InChI=1S/Na.H2O3P.H2O/c;1-4(2)3;/h;1-2H;1H2/q+1;-1;.
What are the key properties of sodium;dihydrogen phosphite;hydrate?
sodium;dihydrogen phosphite;hydrate has a molecular weight of 121.99 g/mol, XLogP of -5.26, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;dihydrogen phosphite;hydrate is sourced from PubChem (CID 162185161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).