2-nitrotellurophene

C4H3NO2Te — CID 100978185

IUPAC2-nitrotellurophene
SMILESO=[N+]([O-])c1ccc[te]1
InChIInChI=1S/C4H3NO2Te/c6-5(7)4-2-1-3-8-4/h1-3H
InChIKeyIRUQZFGTRORPJW-UHFFFAOYSA-N
MW224.67 g/mol
LogP0.65
Rot. Bonds1

About 2-nitrotellurophene

2-nitrotellurophene (PubChem CID 100978185) has the molecular formula C4H3NO2Te and a molecular weight of 224.67 g/mol. Its IUPAC name is 2-nitrotellurophene.

Molecular Properties

Compound Name2-nitrotellurophene
PubChem CID100978185
Molecular FormulaC4H3NO2Te
Molecular Weight224.67 g/mol
Exact Mass226.92
IUPAC Name2-nitrotellurophene
SMILESO=[N+]([O-])c1ccc[te]1
InChIInChI=1S/C4H3NO2Te/c6-5(7)4-2-1-3-8-4/h1-3H
InChIKeyIRUQZFGTRORPJW-UHFFFAOYSA-N
XLogP0.65
TPSA43.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.67
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-nitrotellurophene?
The IUPAC name of 2-nitrotellurophene (CID 100978185) is 2-nitrotellurophene.
What is the SMILES notation for 2-nitrotellurophene?
The canonical SMILES for 2-nitrotellurophene is O=[N+]([O-])c1ccc[te]1.
What is the InChIKey of 2-nitrotellurophene?
The InChIKey is IRUQZFGTRORPJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H3NO2Te/c6-5(7)4-2-1-3-8-4/h1-3H.
What are the key properties of 2-nitrotellurophene?
2-nitrotellurophene has a molecular weight of 224.67 g/mol, XLogP of 0.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-nitrotellurophene is sourced from PubChem (CID 100978185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).