3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione

C8H4O2Te2 — CID 175521421

IUPAC3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione
SMILESO=C1[Te][Te]C(=O)c2cccc1c2
InChIInChI=1S/C8H4O2Te2/c9-7-5-2-1-3-6(4-5)8(10)12-11-7/h1-4H
InChIKeyBIDCTHMXUODTJN-UHFFFAOYSA-N
MW387.32 g/mol
LogP0.30
Rot. Bonds

About 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione

3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione (PubChem CID 175521421) has the molecular formula C8H4O2Te2 and a molecular weight of 387.32 g/mol. Its IUPAC name is 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione.

Molecular Properties

Compound Name3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione
PubChem CID175521421
Molecular FormulaC8H4O2Te2
Molecular Weight387.32 g/mol
Exact Mass391.83
IUPAC Name3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione
SMILESO=C1[Te][Te]C(=O)c2cccc1c2
InChIInChI=1S/C8H4O2Te2/c9-7-5-2-1-3-6(4-5)8(10)12-11-7/h1-4H
InChIKeyBIDCTHMXUODTJN-UHFFFAOYSA-N
XLogP0.30
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.32
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione?
The IUPAC name of 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione (CID 175521421) is 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione.
What is the SMILES notation for 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione?
The canonical SMILES for 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione is O=C1[Te][Te]C(=O)c2cccc1c2.
What is the InChIKey of 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione?
The InChIKey is BIDCTHMXUODTJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H4O2Te2/c9-7-5-2-1-3-6(4-5)8(10)12-11-7/h1-4H.
What are the key properties of 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione?
3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione has a molecular weight of 387.32 g/mol, XLogP of 0.30, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-ditellurabicyclo[4.3.1]deca-1(10),6,8-triene-2,5-dione is sourced from PubChem (CID 175521421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).