CID 19041851

AlBO4P — CID 19041851

IUPAC—
SMILESO=P([O-])([O-])[O-].[Al+3].[B]
InChIInChI=1S/Al.B.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+3;;/p-3
InChIKeyVOJVEQRQCMACGR-UHFFFAOYSA-K
MW132.76 g/mol
LogP-3.59
Rot. Bonds

About CID 19041851

CID 19041851 (PubChem CID 19041851) has the molecular formula AlBO4P and a molecular weight of 132.76 g/mol.

Molecular Properties

Compound NameCID 19041851
PubChem CID19041851
Molecular FormulaAlBO4P
Molecular Weight132.76 g/mol
Exact Mass132.94
IUPAC Name—
SMILESO=P([O-])([O-])[O-].[Al+3].[B]
InChIInChI=1S/Al.B.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+3;;/p-3
InChIKeyVOJVEQRQCMACGR-UHFFFAOYSA-K
XLogP-3.59
TPSA86.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.76
LogP ≤ 5-3.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 19041851?
The IUPAC name of CID 19041851 (CID 19041851) is not available.
What is the SMILES notation for CID 19041851?
The canonical SMILES for CID 19041851 is O=P([O-])([O-])[O-].[Al+3].[B].
What is the InChIKey of CID 19041851?
The InChIKey is VOJVEQRQCMACGR-UHFFFAOYSA-K. The full InChI is InChI=1S/Al.B.H3O4P/c;;1-5(2,3)4/h;;(H3,1,2,3,4)/q+3;;/p-3.
What are the key properties of CID 19041851?
CID 19041851 has a molecular weight of 132.76 g/mol, XLogP of -3.59, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 19041851 is sourced from PubChem (CID 19041851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).