Te-(4-methylphenyl) pent-4-enetelluroate

C12H14OTe — CID 15890803

IUPACTe-(4-methylphenyl) pent-4-enetelluroate
SMILESC=CCCC(=O)[Te]c1ccc(C)cc1
InChIInChI=1S/C12H14OTe/c1-3-4-5-12(13)14-11-8-6-10(2)7-9-11/h3,6-9H,1,4-5H2,2H3
InChIKeyZUIMOZBYFXPVFU-UHFFFAOYSA-N
MW301.84 g/mol
LogP1.82
Rot. Bonds5

About Te-(4-methylphenyl) pent-4-enetelluroate

Te-(4-methylphenyl) pent-4-enetelluroate (PubChem CID 15890803) has the molecular formula C12H14OTe and a molecular weight of 301.84 g/mol. Its IUPAC name is Te-(4-methylphenyl) pent-4-enetelluroate.

Molecular Properties

Compound NameTe-(4-methylphenyl) pent-4-enetelluroate
PubChem CID15890803
Molecular FormulaC12H14OTe
Molecular Weight301.84 g/mol
Exact Mass304.01
IUPAC NameTe-(4-methylphenyl) pent-4-enetelluroate
SMILESC=CCCC(=O)[Te]c1ccc(C)cc1
InChIInChI=1S/C12H14OTe/c1-3-4-5-12(13)14-11-8-6-10(2)7-9-11/h3,6-9H,1,4-5H2,2H3
InChIKeyZUIMOZBYFXPVFU-UHFFFAOYSA-N
XLogP1.82
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.84
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of Te-(4-methylphenyl) pent-4-enetelluroate?
The IUPAC name of Te-(4-methylphenyl) pent-4-enetelluroate (CID 15890803) is Te-(4-methylphenyl) pent-4-enetelluroate.
What is the SMILES notation for Te-(4-methylphenyl) pent-4-enetelluroate?
The canonical SMILES for Te-(4-methylphenyl) pent-4-enetelluroate is C=CCCC(=O)[Te]c1ccc(C)cc1.
What is the InChIKey of Te-(4-methylphenyl) pent-4-enetelluroate?
The InChIKey is ZUIMOZBYFXPVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14OTe/c1-3-4-5-12(13)14-11-8-6-10(2)7-9-11/h3,6-9H,1,4-5H2,2H3.
What are the key properties of Te-(4-methylphenyl) pent-4-enetelluroate?
Te-(4-methylphenyl) pent-4-enetelluroate has a molecular weight of 301.84 g/mol, XLogP of 1.82, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Te-(4-methylphenyl) pent-4-enetelluroate is sourced from PubChem (CID 15890803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).