1,2-benzotellurazole

C7H5NTe — CID 616268

IUPAC1,2-benzotellurazole
SMILESc1ccc2[te]ncc2c1
InChIInChI=1S/C7H5NTe/c1-2-4-7-6(3-1)5-8-9-7/h1-5H
InChIKeyJEVIFSOOJHDRHN-UHFFFAOYSA-N
MW230.72 g/mol
LogP1.29
Rot. Bonds

About 1,2-benzotellurazole

1,2-benzotellurazole (PubChem CID 616268) has the molecular formula C7H5NTe and a molecular weight of 230.72 g/mol. Its IUPAC name is 1,2-benzotellurazole.

Molecular Properties

Compound Name1,2-benzotellurazole
PubChem CID616268
Molecular FormulaC7H5NTe
Molecular Weight230.72 g/mol
Exact Mass232.95
IUPAC Name1,2-benzotellurazole
SMILESc1ccc2[te]ncc2c1
InChIInChI=1S/C7H5NTe/c1-2-4-7-6(3-1)5-8-9-7/h1-5H
InChIKeyJEVIFSOOJHDRHN-UHFFFAOYSA-N
XLogP1.29
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.72
LogP ≤ 51.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1,2-benzotellurazole?
The IUPAC name of 1,2-benzotellurazole (CID 616268) is 1,2-benzotellurazole.
What is the SMILES notation for 1,2-benzotellurazole?
The canonical SMILES for 1,2-benzotellurazole is c1ccc2[te]ncc2c1.
What is the InChIKey of 1,2-benzotellurazole?
The InChIKey is JEVIFSOOJHDRHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NTe/c1-2-4-7-6(3-1)5-8-9-7/h1-5H.
What are the key properties of 1,2-benzotellurazole?
1,2-benzotellurazole has a molecular weight of 230.72 g/mol, XLogP of 1.29, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-benzotellurazole is sourced from PubChem (CID 616268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).