aluminum trihexafluorophosphate

AlF18P3 — CID 160777052

IUPACaluminum trihexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Al+3]
InChIInChI=1S/Al.3F6P/c;3*1-7(2,3,4,5)6/q+3;3*-1
InChIKeySABVQLWDOXBZDG-UHFFFAOYSA-N
MW461.87 g/mol
LogP9.77
Rot. Bonds

About aluminum trihexafluorophosphate

aluminum trihexafluorophosphate (PubChem CID 160777052) has the molecular formula AlF18P3 and a molecular weight of 461.87 g/mol. Its IUPAC name is aluminum trihexafluorophosphate.

Molecular Properties

Compound Namealuminum trihexafluorophosphate
PubChem CID160777052
Molecular FormulaAlF18P3
Molecular Weight461.87 g/mol
Exact Mass461.87
IUPAC Namealuminum trihexafluorophosphate
SMILESF[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Al+3]
InChIInChI=1S/Al.3F6P/c;3*1-7(2,3,4,5)6/q+3;3*-1
InChIKeySABVQLWDOXBZDG-UHFFFAOYSA-N
XLogP9.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.87
LogP ≤ 59.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 trihexafluorophosphate?
The IUPAC name of aluminum trihexafluorophosphate (CID 160777052) is aluminum trihexafluorophosphate.
What is the SMILES notation for aluminum trihexafluorophosphate?
The canonical SMILES for aluminum trihexafluorophosphate is F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.[Al+3].
What is the InChIKey of aluminum trihexafluorophosphate?
The InChIKey is SABVQLWDOXBZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.3F6P/c;3*1-7(2,3,4,5)6/q+3;3*-1.
What are the key properties of aluminum trihexafluorophosphate?
aluminum trihexafluorophosphate has a molecular weight of 461.87 g/mol, XLogP of 9.77, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum trihexafluorophosphate is sourced from PubChem (CID 160777052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).