trialuminum;triphosphate

Al3O12P3 — CID 23371115

IUPACtrialuminum;triphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Al+3].[Al+3].[Al+3]
InChIInChI=1S/3Al.3H3O4P/c;;;3*1-5(2,3)4/h;;;3*(H3,1,2,3,4)/q3*+3;;;/p-9
InChIKeyAYEJCPCSXVFSFD-UHFFFAOYSA-E
MW365.86 g/mol
LogP-9.62
Rot. Bonds

About trialuminum;triphosphate

trialuminum;triphosphate (PubChem CID 23371115) has the molecular formula Al3O12P3 and a molecular weight of 365.86 g/mol. Its IUPAC name is trialuminum;triphosphate.

Molecular Properties

Compound Nametrialuminum;triphosphate
PubChem CID23371115
Molecular FormulaAl3O12P3
Molecular Weight365.86 g/mol
Exact Mass365.80
IUPAC Nametrialuminum;triphosphate
SMILESO=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Al+3].[Al+3].[Al+3]
InChIInChI=1S/3Al.3H3O4P/c;;;3*1-5(2,3)4/h;;;3*(H3,1,2,3,4)/q3*+3;;;/p-9
InChIKeyAYEJCPCSXVFSFD-UHFFFAOYSA-E
XLogP-9.62
TPSA258.75 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500365.86
LogP ≤ 5-9.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

aluminum;bis(indium(3+));triphosphate
CID 174896322
aluminum;iron(2+);phosphate
CID 18314842
CID 19041851
CID 19041851
tetraaluminum;trifluoride;triphosphate
CID 173444901
dialuminum;lithium;titanium(4+);phosphate
CID 157281489
CID 22993124
CID 22993124
aluminum;sodium;hydroxide;phosphate
CID 22287658
dialuminum;magnesium;bis(oxygen(2-));phosphate
CID 172798844
trialuminum;tridecalithium;heptadecakis(titanium(4+));triacontaphosphate
CID 172871694
bis(gadolinium(3+)) diphosphate
CID 172754975
bis(nickel(2+));hydroxide;phosphate
CID 11665794
zirconium diphosphate
CID 3014757

Frequently Asked Questions

What is the IUPAC name of trialuminum;triphosphate?
The IUPAC name of trialuminum;triphosphate (CID 23371115) is trialuminum;triphosphate.
What is the SMILES notation for trialuminum;triphosphate?
The canonical SMILES for trialuminum;triphosphate is O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Al+3].[Al+3].[Al+3].
What is the InChIKey of trialuminum;triphosphate?
The InChIKey is AYEJCPCSXVFSFD-UHFFFAOYSA-E. The full InChI is InChI=1S/3Al.3H3O4P/c;;;3*1-5(2,3)4/h;;;3*(H3,1,2,3,4)/q3*+3;;;/p-9.
What are the key properties of trialuminum;triphosphate?
trialuminum;triphosphate has a molecular weight of 365.86 g/mol, XLogP of -9.62, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for trialuminum;triphosphate is sourced from PubChem (CID 23371115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).