trilithium;phosphane;phosphoric acid;phosphate

H6Li3O8P3 — CID 172777858

IUPACtrilithium;phosphane;phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])([O-])[O-].P.[Li+].[Li+].[Li+]
InChIInChI=1S/3Li.2H3O4P.H3P/c;;;2*1-5(2,3)4;/h;;;2*(H3,1,2,3,4);1H3/q3*+1;;;/p-3
InChIKeyNVSROGOEXOYHQD-UHFFFAOYSA-K
MW247.78 g/mol
LogP-12.68
Rot. Bonds

About trilithium;phosphane;phosphoric acid;phosphate

trilithium;phosphane;phosphoric acid;phosphate (PubChem CID 172777858) has the molecular formula H6Li3O8P3 and a molecular weight of 247.78 g/mol. Its IUPAC name is trilithium;phosphane;phosphoric acid;phosphate.

Molecular Properties

Compound Nametrilithium;phosphane;phosphoric acid;phosphate
PubChem CID172777858
Molecular FormulaH6Li3O8P3
Molecular Weight247.78 g/mol
Exact Mass247.98
IUPAC Nametrilithium;phosphane;phosphoric acid;phosphate
SMILESO=P(O)(O)O.O=P([O-])([O-])[O-].P.[Li+].[Li+].[Li+]
InChIInChI=1S/3Li.2H3O4P.H3P/c;;;2*1-5(2,3)4;/h;;;2*(H3,1,2,3,4);1H3/q3*+1;;;/p-3
InChIKeyNVSROGOEXOYHQD-UHFFFAOYSA-K
XLogP-12.68
TPSA164.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.78
LogP ≤ 5-12.68
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

trilithium;phosphoric acid;phosphate
CID 158468021
lithium;magnesium;phosphoric acid;phosphate
CID 172683948
decaaluminum;phosphoric acid;decaphosphate
CID 173424288
trisodium;phosphoric acid;phosphate
CID 172853200
triazanium;phosphoric acid;phosphate
CID 18943137
triacontacalcium;phosphoric acid;icosaphosphate
CID 173080509
CID 173388644
CID 173388644
diazanium;potassium;phosphoric acid;phosphate
CID 172814489
calcium;sodium;phosphoric acid;phosphate
CID 173179477
pentasodium;hydrogen phosphate;phosphoric acid;phosphate
CID 158487659
phosphane;phosphoric acid
CID 173160232
phosphane;phosphoric acid
CID 172840180

Frequently Asked Questions

What is the IUPAC name of trilithium;phosphane;phosphoric acid;phosphate?
The IUPAC name of trilithium;phosphane;phosphoric acid;phosphate (CID 172777858) is trilithium;phosphane;phosphoric acid;phosphate.
What is the SMILES notation for trilithium;phosphane;phosphoric acid;phosphate?
The canonical SMILES for trilithium;phosphane;phosphoric acid;phosphate is O=P(O)(O)O.O=P([O-])([O-])[O-].P.[Li+].[Li+].[Li+].
What is the InChIKey of trilithium;phosphane;phosphoric acid;phosphate?
The InChIKey is NVSROGOEXOYHQD-UHFFFAOYSA-K. The full InChI is InChI=1S/3Li.2H3O4P.H3P/c;;;2*1-5(2,3)4;/h;;;2*(H3,1,2,3,4);1H3/q3*+1;;;/p-3.
What are the key properties of trilithium;phosphane;phosphoric acid;phosphate?
trilithium;phosphane;phosphoric acid;phosphate has a molecular weight of 247.78 g/mol, XLogP of -12.68, 0 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trilithium;phosphane;phosphoric acid;phosphate is sourced from PubChem (CID 172777858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).