(3,5,6-trimethylpyridazin-4-yl)thallium

C7H9N2Tl — CID 142223510

IUPAC(3,5,6-trimethylpyridazin-4-yl)thallium
SMILESCc1nnc(C)c([Tl])c1C
InChIInChI=1S/C7H9N2.Tl/c1-5-4-6(2)8-9-7(5)3;/h1-3H3;
InChIKeyVZEWIYKIWVDERI-UHFFFAOYSA-N
MW325.55 g/mol
LogP0.20
Rot. Bonds

About (3,5,6-trimethylpyridazin-4-yl)thallium

(3,5,6-trimethylpyridazin-4-yl)thallium (PubChem CID 142223510) has the molecular formula C7H9N2Tl and a molecular weight of 325.55 g/mol. Its IUPAC name is (3,5,6-trimethylpyridazin-4-yl)thallium.

Molecular Properties

Compound Name(3,5,6-trimethylpyridazin-4-yl)thallium
PubChem CID142223510
Molecular FormulaC7H9N2Tl
Molecular Weight325.55 g/mol
Exact Mass326.05
IUPAC Name(3,5,6-trimethylpyridazin-4-yl)thallium
SMILESCc1nnc(C)c([Tl])c1C
InChIInChI=1S/C7H9N2.Tl/c1-5-4-6(2)8-9-7(5)3;/h1-3H3;
InChIKeyVZEWIYKIWVDERI-UHFFFAOYSA-N
XLogP0.20
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.55
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,5,6-trimethylpyridazin-4-yl)thallium?
The IUPAC name of (3,5,6-trimethylpyridazin-4-yl)thallium (CID 142223510) is (3,5,6-trimethylpyridazin-4-yl)thallium.
What is the SMILES notation for (3,5,6-trimethylpyridazin-4-yl)thallium?
The canonical SMILES for (3,5,6-trimethylpyridazin-4-yl)thallium is Cc1nnc(C)c([Tl])c1C.
What is the InChIKey of (3,5,6-trimethylpyridazin-4-yl)thallium?
The InChIKey is VZEWIYKIWVDERI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N2.Tl/c1-5-4-6(2)8-9-7(5)3;/h1-3H3;.
What are the key properties of (3,5,6-trimethylpyridazin-4-yl)thallium?
(3,5,6-trimethylpyridazin-4-yl)thallium has a molecular weight of 325.55 g/mol, XLogP of 0.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5,6-trimethylpyridazin-4-yl)thallium is sourced from PubChem (CID 142223510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).