6-chloro-2-methyl-1,3-benzotellurazole

C8H6ClNTe — CID 15217544

IUPAC6-chloro-2-methyl-1,3-benzotellurazole
SMILESCc1nc2ccc(Cl)cc2[te]1
InChIInChI=1S/C8H6ClNTe/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3
InChIKeyKNSZUGPUNCBRQB-UHFFFAOYSA-N
MW279.20 g/mol
LogP2.25
Rot. Bonds

About 6-chloro-2-methyl-1,3-benzotellurazole

6-chloro-2-methyl-1,3-benzotellurazole (PubChem CID 15217544) has the molecular formula C8H6ClNTe and a molecular weight of 279.20 g/mol. Its IUPAC name is 6-chloro-2-methyl-1,3-benzotellurazole.

Molecular Properties

Compound Name6-chloro-2-methyl-1,3-benzotellurazole
PubChem CID15217544
Molecular FormulaC8H6ClNTe
Molecular Weight279.20 g/mol
Exact Mass280.93
IUPAC Name6-chloro-2-methyl-1,3-benzotellurazole
SMILESCc1nc2ccc(Cl)cc2[te]1
InChIInChI=1S/C8H6ClNTe/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3
InChIKeyKNSZUGPUNCBRQB-UHFFFAOYSA-N
XLogP2.25
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.20
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-methyl-1,3-benzotellurazole?
The IUPAC name of 6-chloro-2-methyl-1,3-benzotellurazole (CID 15217544) is 6-chloro-2-methyl-1,3-benzotellurazole.
What is the SMILES notation for 6-chloro-2-methyl-1,3-benzotellurazole?
The canonical SMILES for 6-chloro-2-methyl-1,3-benzotellurazole is Cc1nc2ccc(Cl)cc2[te]1.
What is the InChIKey of 6-chloro-2-methyl-1,3-benzotellurazole?
The InChIKey is KNSZUGPUNCBRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6ClNTe/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3.
What are the key properties of 6-chloro-2-methyl-1,3-benzotellurazole?
6-chloro-2-methyl-1,3-benzotellurazole has a molecular weight of 279.20 g/mol, XLogP of 2.25, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-methyl-1,3-benzotellurazole is sourced from PubChem (CID 15217544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).