aluminum;calcium;phosphorous acid

H3AlCaO3P+5 — CID 175693603

IUPACaluminum;calcium;phosphorous acid
SMILESOP(O)O.[Al+3].[Ca+2]
InChIInChI=1S/Al.Ca.H3O3P/c;;1-4(2)3/h;;1-3H/q+3;+2;
InChIKeyDZQGIIQLJXFEAB-UHFFFAOYSA-N
MW149.06 g/mol
LogP-1.57
Rot. Bonds

About aluminum;calcium;phosphorous acid

aluminum;calcium;phosphorous acid (PubChem CID 175693603) has the molecular formula H3AlCaO3P+5 and a molecular weight of 149.06 g/mol. Its IUPAC name is aluminum;calcium;phosphorous acid.

Molecular Properties

Compound Namealuminum;calcium;phosphorous acid
PubChem CID175693603
Molecular FormulaH3AlCaO3P+5
Molecular Weight149.06 g/mol
Exact Mass148.92
IUPAC Namealuminum;calcium;phosphorous acid
SMILESOP(O)O.[Al+3].[Ca+2]
InChIInChI=1S/Al.Ca.H3O3P/c;;1-4(2)3/h;;1-3H/q+3;+2;
InChIKeyDZQGIIQLJXFEAB-UHFFFAOYSA-N
XLogP-1.57
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.06
LogP ≤ 5-1.57
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 aluminum;calcium;phosphorous acid?
The IUPAC name of aluminum;calcium;phosphorous acid (CID 175693603) is aluminum;calcium;phosphorous acid.
What is the SMILES notation for aluminum;calcium;phosphorous acid?
The canonical SMILES for aluminum;calcium;phosphorous acid is OP(O)O.[Al+3].[Ca+2].
What is the InChIKey of aluminum;calcium;phosphorous acid?
The InChIKey is DZQGIIQLJXFEAB-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Ca.H3O3P/c;;1-4(2)3/h;;1-3H/q+3;+2;.
What are the key properties of aluminum;calcium;phosphorous acid?
aluminum;calcium;phosphorous acid has a molecular weight of 149.06 g/mol, XLogP of -1.57, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;calcium;phosphorous acid is sourced from PubChem (CID 175693603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).