1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene

C9H12Cl2OTe — CID 3299621

IUPAC1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene
SMILESCCOc1ccc([Te](C)(Cl)Cl)cc1
InChIInChI=1S/C9H12Cl2OTe/c1-3-12-8-4-6-9(7-5-8)13(2,10)11/h4-7H,3H2,1-2H3
InChIKeyBNALOPUKHFKSNR-UHFFFAOYSA-N
MW334.70 g/mol
LogP2.84
Rot. Bonds3

About 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene

1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene (PubChem CID 3299621) has the molecular formula C9H12Cl2OTe and a molecular weight of 334.70 g/mol. Its IUPAC name is 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene.

Molecular Properties

Compound Name1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene
PubChem CID3299621
Molecular FormulaC9H12Cl2OTe
Molecular Weight334.70 g/mol
Exact Mass335.93
IUPAC Name1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene
SMILESCCOc1ccc([Te](C)(Cl)Cl)cc1
InChIInChI=1S/C9H12Cl2OTe/c1-3-12-8-4-6-9(7-5-8)13(2,10)11/h4-7H,3H2,1-2H3
InChIKeyBNALOPUKHFKSNR-UHFFFAOYSA-N
XLogP2.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.70
LogP ≤ 52.84
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-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene?
The IUPAC name of 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene (CID 3299621) is 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene.
What is the SMILES notation for 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene?
The canonical SMILES for 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene is CCOc1ccc([Te](C)(Cl)Cl)cc1.
What is the InChIKey of 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene?
The InChIKey is BNALOPUKHFKSNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12Cl2OTe/c1-3-12-8-4-6-9(7-5-8)13(2,10)11/h4-7H,3H2,1-2H3.
What are the key properties of 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene?
1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene has a molecular weight of 334.70 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[dichloro(methyl)-lambda4-tellanyl]-4-ethoxybenzene is sourced from PubChem (CID 3299621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).