aluminum;oxygen(2-);titanium(4+)

AlOTi+5 — CID 134715798

IUPACaluminum;oxygen(2-);titanium(4+)
SMILES[Al+3].[O-2].[Ti+4]
InChIInChI=1S/Al.O.Ti/q+3;-2;+4
InChIKeyVQYHBXLHGKQYOY-UHFFFAOYSA-N
MW90.85 g/mol
LogP-0.50
Rot. Bonds

About aluminum;oxygen(2-);titanium(4+)

aluminum;oxygen(2-);titanium(4+) (PubChem CID 134715798) has the molecular formula AlOTi+5 and a molecular weight of 90.85 g/mol. Its IUPAC name is aluminum;oxygen(2-);titanium(4+).

Molecular Properties

Compound Namealuminum;oxygen(2-);titanium(4+)
PubChem CID134715798
Molecular FormulaAlOTi+5
Molecular Weight90.85 g/mol
Exact Mass90.92
IUPAC Namealuminum;oxygen(2-);titanium(4+)
SMILES[Al+3].[O-2].[Ti+4]
InChIInChI=1S/Al.O.Ti/q+3;-2;+4
InChIKeyVQYHBXLHGKQYOY-UHFFFAOYSA-N
XLogP-0.50
TPSA28.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms3
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50090.85
LogP ≤ 5-0.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze aluminum;oxygen(2-);titanium(4+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of aluminum;oxygen(2-);titanium(4+)?
The IUPAC name of aluminum;oxygen(2-);titanium(4+) (CID 134715798) is aluminum;oxygen(2-);titanium(4+).
What is the SMILES notation for aluminum;oxygen(2-);titanium(4+)?
The canonical SMILES for aluminum;oxygen(2-);titanium(4+) is [Al+3].[O-2].[Ti+4].
What is the InChIKey of aluminum;oxygen(2-);titanium(4+)?
The InChIKey is VQYHBXLHGKQYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.O.Ti/q+3;-2;+4.
What are the key properties of aluminum;oxygen(2-);titanium(4+)?
aluminum;oxygen(2-);titanium(4+) has a molecular weight of 90.85 g/mol, XLogP of -0.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;oxygen(2-);titanium(4+) is sourced from PubChem (CID 134715798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).