2,5-dimethyl-1,2-benzotellurazol-2-ium

C9H10NTe+ — CID 88517133

IUPAC2,5-dimethyl-1,2-benzotellurazol-2-ium
SMILESCc1ccc2[te][n+](C)cc2c1
InChIInChI=1S/C9H10NTe/c1-7-3-4-9-8(5-7)6-10(2)11-9/h3-6H,1-2H3/q+1
InChIKeyZKOQNNHLJZQAQK-UHFFFAOYSA-N
MW259.79 g/mol
LogP1.03
Rot. Bonds

About 2,5-dimethyl-1,2-benzotellurazol-2-ium

2,5-dimethyl-1,2-benzotellurazol-2-ium (PubChem CID 88517133) has the molecular formula C9H10NTe+ and a molecular weight of 259.79 g/mol. Its IUPAC name is 2,5-dimethyl-1,2-benzotellurazol-2-ium.

Molecular Properties

Compound Name2,5-dimethyl-1,2-benzotellurazol-2-ium
PubChem CID88517133
Molecular FormulaC9H10NTe+
Molecular Weight259.79 g/mol
Exact Mass261.99
IUPAC Name2,5-dimethyl-1,2-benzotellurazol-2-ium
SMILESCc1ccc2[te][n+](C)cc2c1
InChIInChI=1S/C9H10NTe/c1-7-3-4-9-8(5-7)6-10(2)11-9/h3-6H,1-2H3/q+1
InChIKeyZKOQNNHLJZQAQK-UHFFFAOYSA-N
XLogP1.03
TPSA3.88 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.79
LogP ≤ 51.03
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

2,7-dimethylisoquinolin-2-ium;ethane
CID 144617813
2,9-dimethylpentacene
CID 11460950
2,6-dimethylnaphthalene;propane
CID 142191183
3,6,10-trimethylacridin-10-ium
CID 18342016
2,7-dimethylphenanthrene;ethane
CID 91503011
2,6-dimethylnaphthalene;2-methylnaphthalene
CID 158480305
2-methyl-7-[2-(7-methylnaphthalen-2-yl)ethynyl]naphthalene
CID 71486445
2,10-dimethylacridin-10-ium
CID 25896
2-methylnaphthalene chloride
CID 21193556
2-methylnaphthalene;dihydrate
CID 174912803
2,7-dimethylacridine
CID 14490101
benzene;2-methylnaphthalene
CID 159438891

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,2-benzotellurazol-2-ium?
The IUPAC name of 2,5-dimethyl-1,2-benzotellurazol-2-ium (CID 88517133) is 2,5-dimethyl-1,2-benzotellurazol-2-ium.
What is the SMILES notation for 2,5-dimethyl-1,2-benzotellurazol-2-ium?
The canonical SMILES for 2,5-dimethyl-1,2-benzotellurazol-2-ium is Cc1ccc2[te][n+](C)cc2c1.
What is the InChIKey of 2,5-dimethyl-1,2-benzotellurazol-2-ium?
The InChIKey is ZKOQNNHLJZQAQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10NTe/c1-7-3-4-9-8(5-7)6-10(2)11-9/h3-6H,1-2H3/q+1.
What are the key properties of 2,5-dimethyl-1,2-benzotellurazol-2-ium?
2,5-dimethyl-1,2-benzotellurazol-2-ium has a molecular weight of 259.79 g/mol, XLogP of 1.03, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1,2-benzotellurazol-2-ium is sourced from PubChem (CID 88517133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).