2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole

C13H8BrCl2NTe — CID 14248305

IUPAC2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole
SMILESCl[Te]1(Cl)C(c2ccc(Br)cc2)=Nc2ccccc21
InChIInChI=1S/C13H8BrCl2NTe/c14-10-7-5-9(6-8-10)13-17-11-3-1-2-4-12(11)18(13,15)16/h1-8H
InChIKeyQGRITMADBKJWSQ-UHFFFAOYSA-N
MW456.62 g/mol
LogP4.25
Rot. Bonds1

About 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole

2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole (PubChem CID 14248305) has the molecular formula C13H8BrCl2NTe and a molecular weight of 456.62 g/mol. Its IUPAC name is 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole.

Molecular Properties

Compound Name2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole
PubChem CID14248305
Molecular FormulaC13H8BrCl2NTe
Molecular Weight456.62 g/mol
Exact Mass456.83
IUPAC Name2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole
SMILESCl[Te]1(Cl)C(c2ccc(Br)cc2)=Nc2ccccc21
InChIInChI=1S/C13H8BrCl2NTe/c14-10-7-5-9(6-8-10)13-17-11-3-1-2-4-12(11)18(13,15)16/h1-8H
InChIKeyQGRITMADBKJWSQ-UHFFFAOYSA-N
XLogP4.25
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.62
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-Benzylidene-4-bromoaniline
CID 262176
N-(4-Bromobenzylidene)aniline
CID 525674
N-Benzylidene-3-bromoaniline
CID 525548
2-[(E)-2-(4-bromophenyl)ethenyl]-3,3-dimethylindole
CID 13593039
p-Bromobenzylidene-(4-bromophenyl)-amine
CID 525659
N-(4-Bromobenzylidene)-p-toluidine
CID 525663
Benzotellurazole, 1,1-dihydro-1,1-dibromo-2-phenyl-
CID 3088544
N-[(4-Bromophenyl)methylene]-4-fluorobenzenamine
CID 904271
1-(3-bromophenyl)-N-phenylmethanimine
CID 459280
Benzenamine, N-[1-(4-bromophenyl)ethylidene]-
CID 641181
N-Benzylidene-2-bromoaniline
CID 641193
N-(4-bromobenzylidene)-2-trifluoromethylaniline
CID 85801667

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole?
The IUPAC name of 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole (CID 14248305) is 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole.
What is the SMILES notation for 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole?
The canonical SMILES for 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole is Cl[Te]1(Cl)C(c2ccc(Br)cc2)=Nc2ccccc21.
What is the InChIKey of 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole?
The InChIKey is QGRITMADBKJWSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8BrCl2NTe/c14-10-7-5-9(6-8-10)13-17-11-3-1-2-4-12(11)18(13,15)16/h1-8H.
What are the key properties of 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole?
2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole has a molecular weight of 456.62 g/mol, XLogP of 4.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)-1,1-dichloro-1lambda4,3-benzotellurazole is sourced from PubChem (CID 14248305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).