pentakis(propan-2-olate);tantalum(5+)

C15H35O5Ta — CID 12540882

IUPACpentakis(propan-2-olate);tantalum(5+)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ta+5]
InChIInChI=1S/5C3H7O.Ta/c5*1-3(2)4;/h5*3H,1-2H3;/q5*-1;+5
InChIKeyBZXLPZMNHQWSNR-UHFFFAOYSA-N
MW476.39 g/mol
LogP-1.23
Rot. Bonds

About pentakis(propan-2-olate);tantalum(5+)

pentakis(propan-2-olate);tantalum(5+) (PubChem CID 12540882) has the molecular formula C15H35O5Ta and a molecular weight of 476.39 g/mol. Its IUPAC name is pentakis(propan-2-olate);tantalum(5+).

Molecular Properties

Compound Namepentakis(propan-2-olate);tantalum(5+)
PubChem CID12540882
Molecular FormulaC15H35O5Ta
Molecular Weight476.39 g/mol
Exact Mass476.20
IUPAC Namepentakis(propan-2-olate);tantalum(5+)
SMILESCC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ta+5]
InChIInChI=1S/5C3H7O.Ta/c5*1-3(2)4;/h5*3H,1-2H3;/q5*-1;+5
InChIKeyBZXLPZMNHQWSNR-UHFFFAOYSA-N
XLogP-1.23
TPSA115.30 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500476.39
LogP ≤ 5-1.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

Titanium isopropoxide
CID 11026
Tellurium(IV) isopropoxide
CID 15771447
Germanium(IV) isopropoxide
CID 16685043
Zirconium(4+) propan-2-olate
CID 3083750
Tin isopropoxide
CID 16687738
Hafnium tetraisopropoxide
CID 10216384
Niobium(5+) pentapropan-2-olate
CID 12540880
Tungsten(VI) isopropoxide
CID 14419745
Cerium(4+) tetrapropan-2-olate
CID 14473355
Aluminum nickel isopropoxide
CID 18401254
Molybdenum (V) isopropoxide
CID 18475294
Aluminum magnesium isopropoxide
CID 22024083

Frequently Asked Questions

What is the IUPAC name of pentakis(propan-2-olate);tantalum(5+)?
The IUPAC name of pentakis(propan-2-olate);tantalum(5+) (CID 12540882) is pentakis(propan-2-olate);tantalum(5+).
What is the SMILES notation for pentakis(propan-2-olate);tantalum(5+)?
The canonical SMILES for pentakis(propan-2-olate);tantalum(5+) is CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].CC(C)[O-].[Ta+5].
What is the InChIKey of pentakis(propan-2-olate);tantalum(5+)?
The InChIKey is BZXLPZMNHQWSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/5C3H7O.Ta/c5*1-3(2)4;/h5*3H,1-2H3;/q5*-1;+5.
What are the key properties of pentakis(propan-2-olate);tantalum(5+)?
pentakis(propan-2-olate);tantalum(5+) has a molecular weight of 476.39 g/mol, XLogP of -1.23, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(propan-2-olate);tantalum(5+) is sourced from PubChem (CID 12540882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).