hydroxy-oxo-phosphonooxyphosphanium

H3O6P2+ — CID 19095100

IUPAChydroxy-oxo-phosphonooxyphosphanium
SMILESO=[P+](O)OP(=O)(O)O
InChIInChI=1S/H2O6P2/c1-7(2)6-8(3,4)5/h(H2-,1,2,3,4,5)/p+1
InChIKeySKHJOJNSDJKAMA-UHFFFAOYSA-O
MW160.97 g/mol
LogP-0.25
Rot. Bonds2

About hydroxy-oxo-phosphonooxyphosphanium

hydroxy-oxo-phosphonooxyphosphanium (PubChem CID 19095100) has the molecular formula H3O6P2+ and a molecular weight of 160.97 g/mol. Its IUPAC name is hydroxy-oxo-phosphonooxyphosphanium.

Molecular Properties

Compound Namehydroxy-oxo-phosphonooxyphosphanium
PubChem CID19095100
Molecular FormulaH3O6P2+
Molecular Weight160.97 g/mol
Exact Mass160.94
IUPAC Namehydroxy-oxo-phosphonooxyphosphanium
SMILESO=[P+](O)OP(=O)(O)O
InChIInChI=1S/H2O6P2/c1-7(2)6-8(3,4)5/h(H2-,1,2,3,4,5)/p+1
InChIKeySKHJOJNSDJKAMA-UHFFFAOYSA-O
XLogP-0.25
TPSA104.06 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.97
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
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 hydroxy-oxo-phosphonooxyphosphanium?
The IUPAC name of hydroxy-oxo-phosphonooxyphosphanium (CID 19095100) is hydroxy-oxo-phosphonooxyphosphanium.
What is the SMILES notation for hydroxy-oxo-phosphonooxyphosphanium?
The canonical SMILES for hydroxy-oxo-phosphonooxyphosphanium is O=[P+](O)OP(=O)(O)O.
What is the InChIKey of hydroxy-oxo-phosphonooxyphosphanium?
The InChIKey is SKHJOJNSDJKAMA-UHFFFAOYSA-O. The full InChI is InChI=1S/H2O6P2/c1-7(2)6-8(3,4)5/h(H2-,1,2,3,4,5)/p+1.
What are the key properties of hydroxy-oxo-phosphonooxyphosphanium?
hydroxy-oxo-phosphonooxyphosphanium has a molecular weight of 160.97 g/mol, XLogP of -0.25, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-oxo-phosphonooxyphosphanium is sourced from PubChem (CID 19095100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).