1,1-dibromo-2,5-diphenyltellurophene

C32H24Br4Te2 — CID 139120924

IUPAC1,1-dibromo-2,5-diphenyltellurophene
SMILESBr[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1.Br[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1
InChIInChI=1S/2C16H12Br2Te/c2*17-19(18)15(13-7-3-1-4-8-13)11-12-16(19)14-9-5-2-6-10-14/h2*1-12H
InChIKeyMZTIUGSUGUAOAF-UHFFFAOYSA-N
MW983.36 g/mol
LogP10.96
Rot. Bonds4

About 1,1-dibromo-2,5-diphenyltellurophene

1,1-dibromo-2,5-diphenyltellurophene (PubChem CID 139120924) has the molecular formula C32H24Br4Te2 and a molecular weight of 983.36 g/mol. Its IUPAC name is 1,1-dibromo-2,5-diphenyltellurophene.

Molecular Properties

Compound Name1,1-dibromo-2,5-diphenyltellurophene
PubChem CID139120924
Molecular FormulaC32H24Br4Te2
Molecular Weight983.36 g/mol
Exact Mass983.67
IUPAC Name1,1-dibromo-2,5-diphenyltellurophene
SMILESBr[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1.Br[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1
InChIInChI=1S/2C16H12Br2Te/c2*17-19(18)15(13-7-3-1-4-8-13)11-12-16(19)14-9-5-2-6-10-14/h2*1-12H
InChIKeyMZTIUGSUGUAOAF-UHFFFAOYSA-N
XLogP10.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500983.36
LogP ≤ 510.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1-dichloro-2,5-diphenyltellurophene
CID 139140520
benzene;tris(1,1'-biphenyl)
CID 162155747
1,1'-biphenyl;hydrofluoride
CID 67516975
1,1'-biphenyl;mercury
CID 67099988
bis(1,1'-biphenyl);sulfane
CID 22247507
CID 53446764
CID 53446764
benzene;bis(1,1'-biphenyl);methane
CID 158742993
1,1'-biphenyl;indigane
CID 174363765
1,1'-biphenyl;hydroiodide
CID 66586334
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
CID 162140615
CID 162140615
1,1'-biphenyl;molecular hydrogen
CID 173033571

Frequently Asked Questions

What is the IUPAC name of 1,1-dibromo-2,5-diphenyltellurophene?
The IUPAC name of 1,1-dibromo-2,5-diphenyltellurophene (CID 139120924) is 1,1-dibromo-2,5-diphenyltellurophene.
What is the SMILES notation for 1,1-dibromo-2,5-diphenyltellurophene?
The canonical SMILES for 1,1-dibromo-2,5-diphenyltellurophene is Br[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1.Br[Te]1(Br)C(c2ccccc2)=CC=C1c1ccccc1.
What is the InChIKey of 1,1-dibromo-2,5-diphenyltellurophene?
The InChIKey is MZTIUGSUGUAOAF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H12Br2Te/c2*17-19(18)15(13-7-3-1-4-8-13)11-12-16(19)14-9-5-2-6-10-14/h2*1-12H.
What are the key properties of 1,1-dibromo-2,5-diphenyltellurophene?
1,1-dibromo-2,5-diphenyltellurophene has a molecular weight of 983.36 g/mol, XLogP of 10.96, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dibromo-2,5-diphenyltellurophene is sourced from PubChem (CID 139120924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).