1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene

C24H18O2Te2 — CID 13382331

IUPAC1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene
SMILESc1ccc(Oc2ccc([Te][Te]c3ccc(Oc4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C24H18O2Te2/c1-3-7-19(8-4-1)25-21-11-15-23(16-12-21)27-28-24-17-13-22(14-18-24)26-20-9-5-2-6-10-20/h1-18H
InChIKeyLRYFJWDYRUHAEN-UHFFFAOYSA-N
MW593.61 g/mol
LogP4.55
Rot. Bonds7

About 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene

1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene (PubChem CID 13382331) has the molecular formula C24H18O2Te2 and a molecular weight of 593.61 g/mol. Its IUPAC name is 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene.

Molecular Properties

Compound Name1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene
PubChem CID13382331
Molecular FormulaC24H18O2Te2
Molecular Weight593.61 g/mol
Exact Mass597.94
IUPAC Name1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene
SMILESc1ccc(Oc2ccc([Te][Te]c3ccc(Oc4ccccc4)cc3)cc2)cc1
InChIInChI=1S/C24H18O2Te2/c1-3-7-19(8-4-1)25-21-11-15-23(16-12-21)27-28-24-17-13-22(14-18-24)26-20-9-5-2-6-10-20/h1-18H
InChIKeyLRYFJWDYRUHAEN-UHFFFAOYSA-N
XLogP4.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500593.61
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 159259752
1,3,5-tris[4-(4-phenoxyphenoxy)phenoxy]benzene
CID 167430627
potassium;hydride;phenoxybenzene
CID 173391576
oxophosphanium;phenoxybenzene
CID 161329594
4-phenoxyaniline
CID 158390066
boric acid;phenoxybenzene
CID 66799508
ethane-1,2-diol;methanol;phenoxybenzene
CID 174609290
ethane;phenoxybenzene;propane
CID 90923491
chlorobenzene;phenoxybenzene
CID 66911253
1-phenoxy-4-(2-phenylethenyl)benzene
CID 175482284

Frequently Asked Questions

What is the IUPAC name of 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene?
The IUPAC name of 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene (CID 13382331) is 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene.
What is the SMILES notation for 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene?
The canonical SMILES for 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene is c1ccc(Oc2ccc([Te][Te]c3ccc(Oc4ccccc4)cc3)cc2)cc1.
What is the InChIKey of 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene?
The InChIKey is LRYFJWDYRUHAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18O2Te2/c1-3-7-19(8-4-1)25-21-11-15-23(16-12-21)27-28-24-17-13-22(14-18-24)26-20-9-5-2-6-10-20/h1-18H.
What are the key properties of 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene?
1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene has a molecular weight of 593.61 g/mol, XLogP of 4.55, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenoxy-4-[(4-phenoxyphenyl)ditellanyl]benzene is sourced from PubChem (CID 13382331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).