aluminum;hydron;phosphoric acid

H4AlO4P+4 — CID 173045384

IUPACaluminum;hydron;phosphoric acid
SMILESO=P(O)(O)O.[Al+3].[H+]
InChIInChI=1S/Al.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p+1
InChIKeyILRRQNADMUWWFW-UHFFFAOYSA-O
MW125.98 g/mol
LogP-1.20
Rot. Bonds

About aluminum;hydron;phosphoric acid

aluminum;hydron;phosphoric acid (PubChem CID 173045384) has the molecular formula H4AlO4P+4 and a molecular weight of 125.98 g/mol. Its IUPAC name is aluminum;hydron;phosphoric acid.

Molecular Properties

Compound Namealuminum;hydron;phosphoric acid
PubChem CID173045384
Molecular FormulaH4AlO4P+4
Molecular Weight125.98 g/mol
Exact Mass125.96
IUPAC Namealuminum;hydron;phosphoric acid
SMILESO=P(O)(O)O.[Al+3].[H+]
InChIInChI=1S/Al.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p+1
InChIKeyILRRQNADMUWWFW-UHFFFAOYSA-O
XLogP-1.20
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.98
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of aluminum;hydron;phosphoric acid?
The IUPAC name of aluminum;hydron;phosphoric acid (CID 173045384) is aluminum;hydron;phosphoric acid.
What is the SMILES notation for aluminum;hydron;phosphoric acid?
The canonical SMILES for aluminum;hydron;phosphoric acid is O=P(O)(O)O.[Al+3].[H+].
What is the InChIKey of aluminum;hydron;phosphoric acid?
The InChIKey is ILRRQNADMUWWFW-UHFFFAOYSA-O. The full InChI is InChI=1S/Al.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+3;/p+1.
What are the key properties of aluminum;hydron;phosphoric acid?
aluminum;hydron;phosphoric acid has a molecular weight of 125.98 g/mol, XLogP of -1.20, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;hydron;phosphoric acid is sourced from PubChem (CID 173045384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).