7-(trifluoromethyl)-1-benzothiophene-2-tellurol

C9H5F3STe — CID 162611841

IUPAC7-(trifluoromethyl)-1-benzothiophene-2-tellurol
SMILESFC(F)(F)c1cccc2cc([TeH])sc12
InChIInChI=1S/C9H5F3STe/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-4,14H
InChIKeyZJGJLBZJPVKVLU-UHFFFAOYSA-N
MW329.80 g/mol
LogP2.45
Rot. Bonds

About 7-(trifluoromethyl)-1-benzothiophene-2-tellurol

7-(trifluoromethyl)-1-benzothiophene-2-tellurol (PubChem CID 162611841) has the molecular formula C9H5F3STe and a molecular weight of 329.80 g/mol. Its IUPAC name is 7-(trifluoromethyl)-1-benzothiophene-2-tellurol.

Molecular Properties

Compound Name7-(trifluoromethyl)-1-benzothiophene-2-tellurol
PubChem CID162611841
Molecular FormulaC9H5F3STe
Molecular Weight329.80 g/mol
Exact Mass331.91
IUPAC Name7-(trifluoromethyl)-1-benzothiophene-2-tellurol
SMILESFC(F)(F)c1cccc2cc([TeH])sc12
InChIInChI=1S/C9H5F3STe/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-4,14H
InChIKeyZJGJLBZJPVKVLU-UHFFFAOYSA-N
XLogP2.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.80
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 7-(trifluoromethyl)-1-benzothiophene-2-tellurol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)-1-benzothiophene-2-tellurol?
The IUPAC name of 7-(trifluoromethyl)-1-benzothiophene-2-tellurol (CID 162611841) is 7-(trifluoromethyl)-1-benzothiophene-2-tellurol.
What is the SMILES notation for 7-(trifluoromethyl)-1-benzothiophene-2-tellurol?
The canonical SMILES for 7-(trifluoromethyl)-1-benzothiophene-2-tellurol is FC(F)(F)c1cccc2cc([TeH])sc12.
What is the InChIKey of 7-(trifluoromethyl)-1-benzothiophene-2-tellurol?
The InChIKey is ZJGJLBZJPVKVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5F3STe/c10-9(11,12)6-3-1-2-5-4-7(14)13-8(5)6/h1-4,14H.
What are the key properties of 7-(trifluoromethyl)-1-benzothiophene-2-tellurol?
7-(trifluoromethyl)-1-benzothiophene-2-tellurol has a molecular weight of 329.80 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)-1-benzothiophene-2-tellurol is sourced from PubChem (CID 162611841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).