2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene

C14H14Cl2O2Te — CID 162786996

IUPAC2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene
SMILESCOc1ccc(OC)c([Te](Cl)(Cl)c2ccccc2)c1
InChIInChI=1S/C14H14Cl2O2Te/c1-17-11-8-9-13(18-2)14(10-11)19(15,16)12-6-4-3-5-7-12/h3-10H,1-2H3
InChIKeyCPPXCLUMJHGBOI-UHFFFAOYSA-N
MW412.77 g/mol
LogP2.74
Rot. Bonds4

About 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene

2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene (PubChem CID 162786996) has the molecular formula C14H14Cl2O2Te and a molecular weight of 412.77 g/mol. Its IUPAC name is 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene.

Molecular Properties

Compound Name2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene
PubChem CID162786996
Molecular FormulaC14H14Cl2O2Te
Molecular Weight412.77 g/mol
Exact Mass413.94
IUPAC Name2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene
SMILESCOc1ccc(OC)c([Te](Cl)(Cl)c2ccccc2)c1
InChIInChI=1S/C14H14Cl2O2Te/c1-17-11-8-9-13(18-2)14(10-11)19(15,16)12-6-4-3-5-7-12/h3-10H,1-2H3
InChIKeyCPPXCLUMJHGBOI-UHFFFAOYSA-N
XLogP2.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.77
LogP ≤ 52.74
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 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene?
The IUPAC name of 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene (CID 162786996) is 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene.
What is the SMILES notation for 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene?
The canonical SMILES for 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene is COc1ccc(OC)c([Te](Cl)(Cl)c2ccccc2)c1.
What is the InChIKey of 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene?
The InChIKey is CPPXCLUMJHGBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2O2Te/c1-17-11-8-9-13(18-2)14(10-11)19(15,16)12-6-4-3-5-7-12/h3-10H,1-2H3.
What are the key properties of 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene?
2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene has a molecular weight of 412.77 g/mol, XLogP of 2.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[dichloro(phenyl)-λ4-tellanyl]-1,4-dimethoxybenzene is sourced from PubChem (CID 162786996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).