ethyltellanylsulfonylbenzene

C8H10O2STe — CID 139679666

IUPACethyltellanylsulfonylbenzene
SMILESCC[Te]S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10O2STe/c1-2-12-11(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyAGSFJGVLBITLHY-UHFFFAOYSA-N
MW297.83 g/mol
LogP1.52
Rot. Bonds3

About ethyltellanylsulfonylbenzene

ethyltellanylsulfonylbenzene (PubChem CID 139679666) has the molecular formula C8H10O2STe and a molecular weight of 297.83 g/mol. Its IUPAC name is ethyltellanylsulfonylbenzene.

Molecular Properties

Compound Nameethyltellanylsulfonylbenzene
PubChem CID139679666
Molecular FormulaC8H10O2STe
Molecular Weight297.83 g/mol
Exact Mass299.95
IUPAC Nameethyltellanylsulfonylbenzene
SMILESCC[Te]S(=O)(=O)c1ccccc1
InChIInChI=1S/C8H10O2STe/c1-2-12-11(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyAGSFJGVLBITLHY-UHFFFAOYSA-N
XLogP1.52
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.83
LogP ≤ 51.52
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 ethyltellanylsulfonylbenzene?
The IUPAC name of ethyltellanylsulfonylbenzene (CID 139679666) is ethyltellanylsulfonylbenzene.
What is the SMILES notation for ethyltellanylsulfonylbenzene?
The canonical SMILES for ethyltellanylsulfonylbenzene is CC[Te]S(=O)(=O)c1ccccc1.
What is the InChIKey of ethyltellanylsulfonylbenzene?
The InChIKey is AGSFJGVLBITLHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2STe/c1-2-12-11(9,10)8-6-4-3-5-7-8/h3-7H,2H2,1H3.
What are the key properties of ethyltellanylsulfonylbenzene?
ethyltellanylsulfonylbenzene has a molecular weight of 297.83 g/mol, XLogP of 1.52, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyltellanylsulfonylbenzene is sourced from PubChem (CID 139679666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).