oxotantalum;trihydrobromide

H3Br3OTa — CID 173491678

IUPACoxotantalum;trihydrobromide
SMILESBr.Br.Br.O=[Ta]
InChIInChI=1S/3BrH.O.Ta/h3*1H;;
InChIKeyQWARLEBSHIMAIW-UHFFFAOYSA-N
MW439.68 g/mol
LogP1.61
Rot. Bonds

About oxotantalum;trihydrobromide

oxotantalum;trihydrobromide (PubChem CID 173491678) has the molecular formula H3Br3OTa and a molecular weight of 439.68 g/mol. Its IUPAC name is oxotantalum;trihydrobromide.

Molecular Properties

Compound Nameoxotantalum;trihydrobromide
PubChem CID173491678
Molecular FormulaH3Br3OTa
Molecular Weight439.68 g/mol
Exact Mass436.72
IUPAC Nameoxotantalum;trihydrobromide
SMILESBr.Br.Br.O=[Ta]
InChIInChI=1S/3BrH.O.Ta/h3*1H;;
InChIKeyQWARLEBSHIMAIW-UHFFFAOYSA-N
XLogP1.61
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500439.68
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of oxotantalum;trihydrobromide?
The IUPAC name of oxotantalum;trihydrobromide (CID 173491678) is oxotantalum;trihydrobromide.
What is the SMILES notation for oxotantalum;trihydrobromide?
The canonical SMILES for oxotantalum;trihydrobromide is Br.Br.Br.O=[Ta].
What is the InChIKey of oxotantalum;trihydrobromide?
The InChIKey is QWARLEBSHIMAIW-UHFFFAOYSA-N. The full InChI is InChI=1S/3BrH.O.Ta/h3*1H;;.
What are the key properties of oxotantalum;trihydrobromide?
oxotantalum;trihydrobromide has a molecular weight of 439.68 g/mol, XLogP of 1.61, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for oxotantalum;trihydrobromide is sourced from PubChem (CID 173491678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).