trilithium;phosphoric acid;phosphate

H3Li3O8P2 — CID 158468021

IUPACtrilithium;phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])([O-])[O-].[Li+].[Li+].[Li+]
InChIInChI=1S/3Li.2H3O4P/c;;;2*1-5(2,3)4/h;;;2*(H3,1,2,3,4)/q3*+1;;/p-3
InChIKeyHFZQESHWPLWNSE-UHFFFAOYSA-K
MW213.79 g/mol
LogP-12.74
Rot. Bonds

About trilithium;phosphoric acid;phosphate

trilithium;phosphoric acid;phosphate (PubChem CID 158468021) has the molecular formula H3Li3O8P2 and a molecular weight of 213.79 g/mol. Its IUPAC name is trilithium;phosphoric acid;phosphate.

Molecular Properties

Compound Nametrilithium;phosphoric acid;phosphate
PubChem CID158468021
Molecular FormulaH3Li3O8P2
Molecular Weight213.79 g/mol
Exact Mass213.98
IUPAC Nametrilithium;phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])([O-])[O-].[Li+].[Li+].[Li+]
InChIInChI=1S/3Li.2H3O4P/c;;;2*1-5(2,3)4/h;;;2*(H3,1,2,3,4)/q3*+1;;/p-3
InChIKeyHFZQESHWPLWNSE-UHFFFAOYSA-K
XLogP-12.74
TPSA164.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.79
LogP ≤ 5-12.74
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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CID 173388644
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CID 173179477
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Frequently Asked Questions

What is the IUPAC name of trilithium;phosphoric acid;phosphate?
The IUPAC name of trilithium;phosphoric acid;phosphate (CID 158468021) is trilithium;phosphoric acid;phosphate.
What is the SMILES notation for trilithium;phosphoric acid;phosphate?
The canonical SMILES for trilithium;phosphoric acid;phosphate is O=P(O)(O)O.O=P([O-])([O-])[O-].[Li+].[Li+].[Li+].
What is the InChIKey of trilithium;phosphoric acid;phosphate?
The InChIKey is HFZQESHWPLWNSE-UHFFFAOYSA-K. The full InChI is InChI=1S/3Li.2H3O4P/c;;;2*1-5(2,3)4/h;;;2*(H3,1,2,3,4)/q3*+1;;/p-3.
What are the key properties of trilithium;phosphoric acid;phosphate?
trilithium;phosphoric acid;phosphate has a molecular weight of 213.79 g/mol, XLogP of -12.74, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trilithium;phosphoric acid;phosphate is sourced from PubChem (CID 158468021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).