aluminum;calcium;stiborate

AlCaO4Sb+2 — CID 23297457

IUPACaluminum;calcium;stiborate
SMILESO=[Sb]([O-])([O-])[O-].[Al+3].[Ca+2]
InChIInChI=1S/Al.Ca.4O.Sb/q+3;+2;;3*-1;
InChIKeyAZMJAIHOJJDIPK-UHFFFAOYSA-N
MW252.82 g/mol
LogP-4.83
Rot. Bonds

About aluminum;calcium;stiborate

aluminum;calcium;stiborate (PubChem CID 23297457) has the molecular formula AlCaO4Sb+2 and a molecular weight of 252.82 g/mol. Its IUPAC name is aluminum;calcium;stiborate.

Molecular Properties

Compound Namealuminum;calcium;stiborate
PubChem CID23297457
Molecular FormulaAlCaO4Sb+2
Molecular Weight252.82 g/mol
Exact Mass251.83
IUPAC Namealuminum;calcium;stiborate
SMILESO=[Sb]([O-])([O-])[O-].[Al+3].[Ca+2]
InChIInChI=1S/Al.Ca.4O.Sb/q+3;+2;;3*-1;
InChIKeyAZMJAIHOJJDIPK-UHFFFAOYSA-N
XLogP-4.83
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.82
LogP ≤ 5-4.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of aluminum;calcium;stiborate?
The IUPAC name of aluminum;calcium;stiborate (CID 23297457) is aluminum;calcium;stiborate.
What is the SMILES notation for aluminum;calcium;stiborate?
The canonical SMILES for aluminum;calcium;stiborate is O=[Sb]([O-])([O-])[O-].[Al+3].[Ca+2].
What is the InChIKey of aluminum;calcium;stiborate?
The InChIKey is AZMJAIHOJJDIPK-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.Ca.4O.Sb/q+3;+2;;3*-1;.
What are the key properties of aluminum;calcium;stiborate?
aluminum;calcium;stiborate has a molecular weight of 252.82 g/mol, XLogP of -4.83, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;calcium;stiborate is sourced from PubChem (CID 23297457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).