Tetraphosphoric acid,sodium salt (1:)

H6NaO13P4 — CID 156595361

IUPAC—
SMILESO=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.[Na]
InChIInChI=1S/Na.H6O13P4/c;1-14(2,3)11-16(7,8)13-17(9,10)12-15(4,5)6/h;(H,7,8)(H,9,10)(H2,1,2,3)(H2,4,5,6)
InChIKeyKKMMIPOCMMFXFT-UHFFFAOYSA-N
MW360.92 g/mol
LogP-0.96
Rot. Bonds6

About Tetraphosphoric acid,sodium salt (1:)

Tetraphosphoric acid,sodium salt (1:) (PubChem CID 156595361) has the molecular formula H6NaO13P4 and a molecular weight of 360.92 g/mol.

Molecular Properties

Compound NameTetraphosphoric acid,sodium salt (1:)
PubChem CID156595361
Molecular FormulaH6NaO13P4
Molecular Weight360.92 g/mol
Exact Mass360.87
IUPAC Name—
SMILESO=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.[Na]
InChIInChI=1S/Na.H6O13P4/c;1-14(2,3)11-16(7,8)13-17(9,10)12-15(4,5)6/h;(H,7,8)(H,9,10)(H2,1,2,3)(H2,4,5,6)
InChIKeyKKMMIPOCMMFXFT-UHFFFAOYSA-N
XLogP-0.96
TPSA217.35 Ų
H-Bond Donors6
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.92
LogP ≤ 5-0.96
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of Tetraphosphoric acid,sodium salt (1:)?
The IUPAC name of Tetraphosphoric acid,sodium salt (1:) (CID 156595361) is not available.
What is the SMILES notation for Tetraphosphoric acid,sodium salt (1:)?
The canonical SMILES for Tetraphosphoric acid,sodium salt (1:) is O=P(O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)O.[Na].
What is the InChIKey of Tetraphosphoric acid,sodium salt (1:)?
The InChIKey is KKMMIPOCMMFXFT-UHFFFAOYSA-N. The full InChI is InChI=1S/Na.H6O13P4/c;1-14(2,3)11-16(7,8)13-17(9,10)12-15(4,5)6/h;(H,7,8)(H,9,10)(H2,1,2,3)(H2,4,5,6).
What are the key properties of Tetraphosphoric acid,sodium salt (1:)?
Tetraphosphoric acid,sodium salt (1:) has a molecular weight of 360.92 g/mol, XLogP of -0.96, 6 rotatable bonds, 6 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for Tetraphosphoric acid,sodium salt (1:) is sourced from PubChem (CID 156595361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).