pentakis(dioxido(oxo)titanium);bis(tantalum(5+))

O15Ta2Ti5 — CID 173073397

IUPACpentakis(dioxido(oxo)titanium);bis(tantalum(5+))
SMILESO=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].[Ta+5].[Ta+5]
InChIInChI=1S/15O.2Ta.5Ti/q;;;;;10*-1;2*+5;;;;;
InChIKeyZVRUAGUVICYGBN-UHFFFAOYSA-N
MW841.22 g/mol
LogP-12.50
Rot. Bonds

About pentakis(dioxido(oxo)titanium);bis(tantalum(5+))

pentakis(dioxido(oxo)titanium);bis(tantalum(5+)) (PubChem CID 173073397) has the molecular formula O15Ta2Ti5 and a molecular weight of 841.22 g/mol. Its IUPAC name is pentakis(dioxido(oxo)titanium);bis(tantalum(5+)).

Molecular Properties

Compound Namepentakis(dioxido(oxo)titanium);bis(tantalum(5+))
PubChem CID173073397
Molecular FormulaO15Ta2Ti5
Molecular Weight841.22 g/mol
Exact Mass841.56
IUPAC Namepentakis(dioxido(oxo)titanium);bis(tantalum(5+))
SMILESO=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].[Ta+5].[Ta+5]
InChIInChI=1S/15O.2Ta.5Ti/q;;;;;10*-1;2*+5;;;;;
InChIKeyZVRUAGUVICYGBN-UHFFFAOYSA-N
XLogP-12.50
TPSA315.95 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500841.22
LogP ≤ 5-12.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

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Related Compounds

bis(dioxido(oxo)titanium);hafnium(4+)
CID 133108849
bis(barium(2+));pentakis(dioxido(oxo)titanium);bis(yttrium(3+))
CID 173429333
dipotassium;barium(2+);bis(dioxido(oxo)titanium)
CID 173009495
sodium;cerium(3+);bis(dioxido(oxo)titanium)
CID 173434356
tripotassium;dioxido(oxo)titanium;fluoride
CID 173026949
bis(dioxido(oxo)titanium);lanthanum;zirconium(4+)
CID 173160198
barium(2+);bis(dioxido(oxo)titanium);nickel(2+)
CID 173440950
bis(barium(2+));pentakis(dioxido(oxo)titanium);bis(europium(3+))
CID 173272431
calcium;barium(2+);tetrakis(dioxido(oxo)titanium);zirconium(4+)
CID 173013014
dioxido(oxo)titanium;bis(lead(2+));carbonate
CID 173394753
pentapotassium;dioxido(oxo)titanium;phosphate
CID 173033636
tristrontium;bis(dioxido(oxo)titanium);bis(oxido(dioxo)bismuth)
CID 173193195

Frequently Asked Questions

What is the IUPAC name of pentakis(dioxido(oxo)titanium);bis(tantalum(5+))?
The IUPAC name of pentakis(dioxido(oxo)titanium);bis(tantalum(5+)) (CID 173073397) is pentakis(dioxido(oxo)titanium);bis(tantalum(5+)).
What is the SMILES notation for pentakis(dioxido(oxo)titanium);bis(tantalum(5+))?
The canonical SMILES for pentakis(dioxido(oxo)titanium);bis(tantalum(5+)) is O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].O=[Ti]([O-])[O-].[Ta+5].[Ta+5].
What is the InChIKey of pentakis(dioxido(oxo)titanium);bis(tantalum(5+))?
The InChIKey is ZVRUAGUVICYGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/15O.2Ta.5Ti/q;;;;;10*-1;2*+5;;;;;.
What are the key properties of pentakis(dioxido(oxo)titanium);bis(tantalum(5+))?
pentakis(dioxido(oxo)titanium);bis(tantalum(5+)) has a molecular weight of 841.22 g/mol, XLogP of -12.50, 0 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(dioxido(oxo)titanium);bis(tantalum(5+)) is sourced from PubChem (CID 173073397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).